ZINC 12

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
FOLH1-1-E	Glutamate Carboxypeptidase II (cluster #1 Of 2), Eukaryotic	Eukaryotes	9500	0.54	Binding ≤ 10μM
GRIA1-1-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #1 Of 4), Eukaryotic	Eukaryotes	80	0.76	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	80	0.76	Binding ≤ 10μM
GRIA3-4-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #4 Of 4), Eukaryotic	Eukaryotes	80	0.76	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	80	0.76	Binding ≤ 10μM
GRIK1-3-E	Glutamate Receptor Ionotropic Kainate 1 (cluster #3 Of 3), Eukaryotic	Eukaryotes	171	0.73	Binding ≤ 10μM
GRIK2-3-E	Glutamate Receptor Ionotropic Kainate 2 (cluster #3 Of 3), Eukaryotic	Eukaryotes	150	0.73	Binding ≤ 10μM
GRIK3-3-E	Glutamate Receptor Ionotropic Kainate 3 (cluster #3 Of 3), Eukaryotic	Eukaryotes	1670	0.62	Binding ≤ 10μM
GRIK4-2-E	Glutamate Receptor Ionotropic Kainate 4 (cluster #2 Of 2), Eukaryotic	Eukaryotes	150	0.73	Binding ≤ 10μM
GRIK5-1-E	Glutamate Receptor Ionotropic Kainate 5 (cluster #1 Of 2), Eukaryotic	Eukaryotes	150	0.73	Binding ≤ 10μM
GRM1-2-E	Metabotropic Glutamate Receptor 1 (cluster #2 Of 3), Eukaryotic	Eukaryotes	200	0.72	Binding ≤ 10μM
GRM3-1-E	Metabotropic Glutamate Receptor 3 (cluster #1 Of 1), Eukaryotic	Eukaryotes	25	0.82	Binding ≤ 10μM
GRM5-2-E	Metabotropic Glutamate Receptor 5 (cluster #2 Of 5), Eukaryotic	Eukaryotes	150	0.73	Binding ≤ 10μM
GRM7-1-E	Metabotropic Glutamate Receptor 7 (cluster #1 Of 1), Eukaryotic	Eukaryotes	25	0.82	Binding ≤ 10μM
GRM8-2-E	Metabotropic Glutamate Receptor 8 (cluster #2 Of 2), Eukaryotic	Eukaryotes	25	0.82	Binding ≤ 10μM
Q80T35-1-E	Metabotropic Glutamate Receptor 6 (cluster #1 Of 1), Eukaryotic	Eukaryotes	25	0.82	Binding ≤ 10μM
Q80T43-1-E	Metabotropic Glutamate Receptor 2 (cluster #1 Of 1), Eukaryotic	Eukaryotes	25	0.82	Binding ≤ 10μM
Q80T47-1-E	Metabotropic Glutamate Receptor 5 (cluster #1 Of 1), Eukaryotic	Eukaryotes	25	0.82	Binding ≤ 10μM
XCT-1-E	Cystine/glutamate Transporter (cluster #1 Of 2), Eukaryotic	Eukaryotes	5000	0.57	Binding ≤ 10μM
GRM1-3-E	Metabotropic Glutamate Receptor 1 (cluster #3 Of 5), Eukaryotic	Eukaryotes	1100	0.64	Functional ≤ 10μM
GRM5-4-E	Metabotropic Glutamate Receptor 5 (cluster #4 Of 5), Eukaryotic	Eukaryotes	55	0.78	Functional ≤ 10μM
Z50597-1-O	Rattus Norvegicus (cluster #1 Of 12), Other	Other	7300	0.55	Functional ≤ 10μM

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-4.04	-4.9	-43.55	3	8	-1	139	188.119	3	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	-4.04	-5.21	-87.71	2	8	-2	137	187.111	3	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	-4.04	-7.81	-15.85	4	8	0	132	189.127	3	↓ MOL2 SDF SMILES Flexibase

1490608

Analogs

39958417

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-CPW399 (S)-CPW399

Find On: PubMed — Wikipedia — Google

Vendors

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRIA1-2-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #2 Of 4), Eukaryotic	Eukaryotes	747	0.50	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	747	0.50	Binding ≤ 10μM
GRIA3-4-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #4 Of 4), Eukaryotic	Eukaryotes	747	0.50	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	747	0.50	Binding ≤ 10μM
GRIK1-3-E	Glutamate Receptor Ionotropic Kainate 1 (cluster #3 Of 3), Eukaryotic	Eukaryotes	7940	0.42	Binding ≤ 10μM
GRIK2-1-E	Glutamate Receptor Ionotropic Kainate 2 (cluster #1 Of 3), Eukaryotic	Eukaryotes	7940	0.42	Binding ≤ 10μM
GRIK3-1-E	Glutamate Receptor Ionotropic Kainate 3 (cluster #1 Of 3), Eukaryotic	Eukaryotes	7940	0.42	Binding ≤ 10μM
GRIK4-1-E	Glutamate Receptor Ionotropic Kainate 4 (cluster #1 Of 2), Eukaryotic	Eukaryotes	7940	0.42	Binding ≤ 10μM
GRIK5-1-E	Glutamate Receptor Ionotropic Kainate 5 (cluster #1 Of 2), Eukaryotic	Eukaryotes	7940	0.42	Binding ≤ 10μM

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-3.30	1.57	-42.15	4	7	0	123	239.231	3	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	-3.30	1.24	-43.8	3	7	-1	121	238.223	3	↓ MOL2 SDF SMILES Flexibase

901774

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-Willardiine (S)-Willardiine

Find On: PubMed — Wikipedia — Google

Vendors

And 5 More

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRIA1-2-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #2 Of 4), Eukaryotic	Eukaryotes	386	0.64	Binding ≤ 10μM
GRIA1-2-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #2 Of 4), Eukaryotic	Eukaryotes	1800	0.57	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	898	0.60	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	1800	0.57	Binding ≤ 10μM
GRIA3-4-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #4 Of 4), Eukaryotic	Eukaryotes	1800	0.57	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	1800	0.57	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	8850	0.51	Binding ≤ 10μM

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-4.25	-0.27	-47.38	4	7	0	123	199.166	3	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	-3.82	-3.19	-102.6	2	7	-2	124	197.15	3	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	-3.82	-2.83	-75.1	3	7	-1	126	198.158	3	↓ MOL2 SDF SMILES Flexibase

3108048

Analogs

Draw Identity 99% 90% 80% 70%

Find On: PubMed — Wikipedia — Google

Vendors

And 1 More

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRIA1-2-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #2 Of 4), Eukaryotic	Eukaryotes	1800	0.57	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	1800	0.57	Binding ≤ 10μM
GRIA3-4-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #4 Of 4), Eukaryotic	Eukaryotes	1800	0.57	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	1800	0.57	Binding ≤ 10μM

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-4.25	-0.34	-36.55	4	7	0	123	199.166	3	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	-3.82	-2.81	-56.06	3	7	-1	126	198.158	3	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	-3.82	-3.11	-99.45	2	7	-2	124	197.15	3	↓ MOL2 SDF SMILES Flexibase

27191322

Analogs

Draw Identity 99% 90% 80% 70%

Find On: PubMed — Wikipedia — Google

Vendors

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRIA1-2-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #2 Of 4), Eukaryotic	Eukaryotes	120	0.57	Binding ≤ 10μM
GRIA1-2-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #2 Of 4), Eukaryotic	Eukaryotes	279	0.54	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	115	0.57	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	120	0.57	Binding ≤ 10μM
GRIA3-4-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #4 Of 4), Eukaryotic	Eukaryotes	120	0.57	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	120	0.57	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	207	0.55	Binding ≤ 10μM
GRIK1-2-E	Glutamate Receptor Ionotropic Kainate 1 (cluster #2 Of 3), Eukaryotic	Eukaryotes	3700	0.45	Binding ≤ 10μM
GRIK2-1-E	Glutamate Receptor Ionotropic Kainate 2 (cluster #1 Of 3), Eukaryotic	Eukaryotes	3700	0.45	Binding ≤ 10μM
GRIK3-1-E	Glutamate Receptor Ionotropic Kainate 3 (cluster #1 Of 3), Eukaryotic	Eukaryotes	3700	0.45	Binding ≤ 10μM
GRIK4-1-E	Glutamate Receptor Ionotropic Kainate 4 (cluster #1 Of 2), Eukaryotic	Eukaryotes	3700	0.45	Binding ≤ 10μM
GRIK5-1-E	Glutamate Receptor Ionotropic Kainate 5 (cluster #1 Of 2), Eukaryotic	Eukaryotes	393	0.53	Binding ≤ 10μM
GRIK5-1-E	Glutamate Receptor Ionotropic Kainate 5 (cluster #1 Of 2), Eukaryotic	Eukaryotes	3700	0.45	Binding ≤ 10μM

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-3.61	-1.5	-58.63	3	10	-1	172	243.155	4	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	-3.61	-1.72	-91.85	2	10	-2	170	242.147	4	↓ MOL2 SDF SMILES Flexibase

28108493

Analogs

Draw Identity 99% 90% 80% 70%

Find On: PubMed — Wikipedia — Google

Vendors

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRIA1-2-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #2 Of 4), Eukaryotic	Eukaryotes	120	0.57	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	120	0.57	Binding ≤ 10μM
GRIA3-4-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #4 Of 4), Eukaryotic	Eukaryotes	120	0.57	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	120	0.57	Binding ≤ 10μM
GRIK1-2-E	Glutamate Receptor Ionotropic Kainate 1 (cluster #2 Of 3), Eukaryotic	Eukaryotes	3700	0.45	Binding ≤ 10μM
GRIK2-1-E	Glutamate Receptor Ionotropic Kainate 2 (cluster #1 Of 3), Eukaryotic	Eukaryotes	3700	0.45	Binding ≤ 10μM
GRIK3-1-E	Glutamate Receptor Ionotropic Kainate 3 (cluster #1 Of 3), Eukaryotic	Eukaryotes	3700	0.45	Binding ≤ 10μM
GRIK4-1-E	Glutamate Receptor Ionotropic Kainate 4 (cluster #1 Of 2), Eukaryotic	Eukaryotes	3700	0.45	Binding ≤ 10μM
GRIK5-1-E	Glutamate Receptor Ionotropic Kainate 5 (cluster #1 Of 2), Eukaryotic	Eukaryotes	3700	0.45	Binding ≤ 10μM

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-3.61	-1.43	-75.9	3	10	-1	172	243.155	4	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	-3.61	-1.73	-92.3	2	10	-2	170	242.147	4	↓ MOL2 SDF SMILES Flexibase

2047689

Analogs

12504088

Draw Identity 99% 90% 80% 70%

Find On: PubMed — Wikipedia — Google

Vendors

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRIA1-2-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #2 Of 4), Eukaryotic	Eukaryotes	35	0.70	Binding ≤ 10μM
GRIA1-2-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #2 Of 4), Eukaryotic	Eukaryotes	92	0.66	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	61	0.67	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	101	0.65	Binding ≤ 10μM
GRIA3-4-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #4 Of 4), Eukaryotic	Eukaryotes	434	0.59	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	457	0.59	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	656	0.58	Binding ≤ 10μM
GRIK1-3-E	Glutamate Receptor Ionotropic Kainate 1 (cluster #3 Of 3), Eukaryotic	Eukaryotes	15	0.73	Binding ≤ 10μM
GRIK5-1-E	Glutamate Receptor Ionotropic Kainate 5 (cluster #1 Of 2), Eukaryotic	Eukaryotes	9	0.75	Binding ≤ 10μM
GRIA1-2-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #2 Of 3), Eukaryotic	Eukaryotes	2800	0.52	Functional ≤ 10μM

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-3.22	-4.87	-39.23	4	7	0	122	278.062	3	↓ MOL2 SDF SMILES Flexibase

12504088

Analogs

2047689

Draw Identity 99% 90% 80% 70%

Find On: PubMed — Wikipedia — Google

Vendors

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRIA1-2-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #2 Of 4), Eukaryotic	Eukaryotes	35	0.70	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	61	0.67	Binding ≤ 10μM
GRIA3-4-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #4 Of 4), Eukaryotic	Eukaryotes	434	0.59	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	656	0.58	Binding ≤ 10μM
GRIK1-3-E	Glutamate Receptor Ionotropic Kainate 1 (cluster #3 Of 3), Eukaryotic	Eukaryotes	15	0.73	Binding ≤ 10μM

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-3.22	-0.58	-48.46	4	7	0	123	278.062	3	↓ MOL2 SDF SMILES Flexibase

19943127

Analogs

Draw Identity 99% 90% 80% 70%

Find On: PubMed — Wikipedia — Google

Vendors

And 1 More

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRIA1-1-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #1 Of 4), Eukaryotic	Eukaryotes	170	0.73	Binding ≤ 10μM
GRIA1-1-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #1 Of 4), Eukaryotic	Eukaryotes	340	0.70	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	250	0.71	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	340	0.70	Binding ≤ 10μM
GRIA3-4-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #4 Of 4), Eukaryotic	Eukaryotes	340	0.70	Binding ≤ 10μM
GRIA3-4-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #4 Of 4), Eukaryotic	Eukaryotes	600	0.67	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	340	0.70	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	600	0.67	Binding ≤ 10μM
GRIK1-1-E	Glutamate Receptor Ionotropic Kainate 1 (cluster #1 Of 3), Eukaryotic	Eukaryotes	4800	0.57	Binding ≤ 10μM
GRM1-2-E	Metabotropic Glutamate Receptor 1 (cluster #2 Of 3), Eukaryotic	Eukaryotes	200	0.72	Binding ≤ 10μM
GRM1-2-E	Metabotropic Glutamate Receptor 1 (cluster #2 Of 3), Eukaryotic	Eukaryotes	220	0.72	Binding ≤ 10μM
GRM3-1-E	Metabotropic Glutamate Receptor 3 (cluster #1 Of 1), Eukaryotic	Eukaryotes	200	0.72	Binding ≤ 10μM
GRM3-1-E	Metabotropic Glutamate Receptor 3 (cluster #1 Of 1), Eukaryotic	Eukaryotes	220	0.72	Binding ≤ 10μM
GRM7-1-E	Metabotropic Glutamate Receptor 7 (cluster #1 Of 1), Eukaryotic	Eukaryotes	200	0.72	Binding ≤ 10μM
GRM7-1-E	Metabotropic Glutamate Receptor 7 (cluster #1 Of 1), Eukaryotic	Eukaryotes	220	0.72	Binding ≤ 10μM
GRM8-2-E	Metabotropic Glutamate Receptor 8 (cluster #2 Of 2), Eukaryotic	Eukaryotes	200	0.72	Binding ≤ 10μM
GRM8-2-E	Metabotropic Glutamate Receptor 8 (cluster #2 Of 2), Eukaryotic	Eukaryotes	220	0.72	Binding ≤ 10μM
Q80T35-1-E	Metabotropic Glutamate Receptor 6 (cluster #1 Of 1), Eukaryotic	Eukaryotes	200	0.72	Binding ≤ 10μM
Q80T35-1-E	Metabotropic Glutamate Receptor 6 (cluster #1 Of 1), Eukaryotic	Eukaryotes	220	0.72	Binding ≤ 10μM
Q80T43-1-E	Metabotropic Glutamate Receptor 2 (cluster #1 Of 1), Eukaryotic	Eukaryotes	200	0.72	Binding ≤ 10μM
Q80T43-1-E	Metabotropic Glutamate Receptor 2 (cluster #1 Of 1), Eukaryotic	Eukaryotes	220	0.72	Binding ≤ 10μM
Q80T47-1-E	Metabotropic Glutamate Receptor 5 (cluster #1 Of 1), Eukaryotic	Eukaryotes	200	0.72	Binding ≤ 10μM
Q80T47-1-E	Metabotropic Glutamate Receptor 5 (cluster #1 Of 1), Eukaryotic	Eukaryotes	220	0.72	Binding ≤ 10μM
GRIA2-1-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #1 Of 4), Eukaryotic	Eukaryotes	5400	0.57	Functional ≤ 10μM
GRIA3-2-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #2 Of 2), Eukaryotic	Eukaryotes	600	0.67	Functional ≤ 10μM
GRIA4-2-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #2 Of 3), Eukaryotic	Eukaryotes	600	0.67	Functional ≤ 10μM
Z50597-1-O	Rattus Norvegicus (cluster #1 Of 12), Other	Other	200	0.72	Functional ≤ 10μM
Z50597-1-O	Rattus Norvegicus (cluster #1 Of 12), Other	Other	220	0.72	Functional ≤ 10μM

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-2.32	-0.57	-40.2	3	6	-1	112	250.028	3	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	-1.86	-2.1	-91.82	2	6	-2	115	249.02	3	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	-2.32	-0.24	-33.53	4	6	0	114	251.036	3	↓ MOL2 SDF SMILES Flexibase

19850499

Analogs

19850502

Draw Identity 99% 90% 80% 70%

Popular Name: AMPA AMPA

Find On: PubMed — Wikipedia — Google

Vendors

And 20 More

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRIA1-1-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #1 Of 4), Eukaryotic	Eukaryotes	364	0.69	Binding ≤ 10μM
GRIA1-1-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #1 Of 4), Eukaryotic	Eukaryotes	4800	0.57	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	364	0.69	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	4800	0.57	Binding ≤ 10μM
GRIA3-4-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #4 Of 4), Eukaryotic	Eukaryotes	40	0.80	Binding ≤ 10μM
GRIA3-4-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #4 Of 4), Eukaryotic	Eukaryotes	4800	0.57	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	40	0.80	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	4800	0.57	Binding ≤ 10μM
GRIK1-1-E	Glutamate Receptor Ionotropic Kainate 1 (cluster #1 Of 3), Eukaryotic	Eukaryotes	740	0.66	Binding ≤ 10μM
GRIK2-3-E	Glutamate Receptor Ionotropic Kainate 2 (cluster #3 Of 3), Eukaryotic	Eukaryotes	12	0.85	Binding ≤ 10μM
GRIK3-3-E	Glutamate Receptor Ionotropic Kainate 3 (cluster #3 Of 3), Eukaryotic	Eukaryotes	12	0.85	Binding ≤ 10μM
GRIK4-1-E	Glutamate Receptor Ionotropic Kainate 4 (cluster #1 Of 2), Eukaryotic	Eukaryotes	12	0.85	Binding ≤ 10μM
GRIK5-1-E	Glutamate Receptor Ionotropic Kainate 5 (cluster #1 Of 2), Eukaryotic	Eukaryotes	12	0.85	Binding ≤ 10μM
GRIA1-1-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #1 Of 3), Eukaryotic	Eukaryotes	3310	0.59	Functional ≤ 10μM
GRIA2-1-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #1 Of 4), Eukaryotic	Eukaryotes	3310	0.59	Functional ≤ 10μM
GRIA3-1-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #1 Of 2), Eukaryotic	Eukaryotes	3500	0.59	Functional ≤ 10μM
GRIA4-1-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #1 Of 3), Eukaryotic	Eukaryotes	3500	0.59	Functional ≤ 10μM
Z50597-1-O	Rattus Norvegicus (cluster #1 Of 12), Other	Other	800	0.66	Functional ≤ 10μM
Z50597-1-O	Rattus Norvegicus (cluster #1 Of 12), Other	Other	4800	0.57	Functional ≤ 10μM

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-2.69	-1.91	-52.1	3	6	-1	117	185.159	3	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	-2.69	-2.52	-37.61	4	6	0	114	186.167	3	↓ MOL2 SDF SMILES Flexibase

19850502

Analogs

19850499

Draw Identity 99% 90% 80% 70%

Popular Name: AMPA AMPA

Find On: PubMed — Wikipedia — Google

Vendors

And 23 More

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRIA1-1-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #1 Of 4), Eukaryotic	Eukaryotes	22	0.82	Binding ≤ 10μM
GRIA1-1-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #1 Of 4), Eukaryotic	Eukaryotes	364	0.69	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	17	0.84	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	364	0.69	Binding ≤ 10μM
GRIA3-4-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #4 Of 4), Eukaryotic	Eukaryotes	21	0.83	Binding ≤ 10μM
GRIA3-4-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #4 Of 4), Eukaryotic	Eukaryotes	40	0.80	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	40	0.80	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	40	0.80	Binding ≤ 10μM
GRIK1-1-E	Glutamate Receptor Ionotropic Kainate 1 (cluster #1 Of 3), Eukaryotic	Eukaryotes	740	0.66	Binding ≤ 10μM
GRIK1-1-E	Glutamate Receptor Ionotropic Kainate 1 (cluster #1 Of 3), Eukaryotic	Eukaryotes	1150	0.64	Binding ≤ 10μM
GRIK2-3-E	Glutamate Receptor Ionotropic Kainate 2 (cluster #3 Of 3), Eukaryotic	Eukaryotes	12	0.85	Binding ≤ 10μM
GRIK3-3-E	Glutamate Receptor Ionotropic Kainate 3 (cluster #3 Of 3), Eukaryotic	Eukaryotes	12	0.85	Binding ≤ 10μM
GRIK4-1-E	Glutamate Receptor Ionotropic Kainate 4 (cluster #1 Of 2), Eukaryotic	Eukaryotes	12	0.85	Binding ≤ 10μM
GRIK5-1-E	Glutamate Receptor Ionotropic Kainate 5 (cluster #1 Of 2), Eukaryotic	Eukaryotes	12	0.85	Binding ≤ 10μM
GRIK5-1-E	Glutamate Receptor Ionotropic Kainate 5 (cluster #1 Of 2), Eukaryotic	Eukaryotes	2144	0.61	Binding ≤ 10μM
GRIA1-1-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #1 Of 3), Eukaryotic	Eukaryotes	3310	0.59	Functional ≤ 10μM
GRIA1-1-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #1 Of 3), Eukaryotic	Eukaryotes	3500	0.59	Functional ≤ 10μM
GRIA2-1-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #1 Of 4), Eukaryotic	Eukaryotes	3310	0.59	Functional ≤ 10μM
GRIA2-1-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #1 Of 4), Eukaryotic	Eukaryotes	3500	0.59	Functional ≤ 10μM
GRIA3-1-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #1 Of 2), Eukaryotic	Eukaryotes	3500	0.59	Functional ≤ 10μM
GRIA3-1-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #1 Of 2), Eukaryotic	Eukaryotes	3500	0.59	Functional ≤ 10μM
GRIA4-1-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #1 Of 3), Eukaryotic	Eukaryotes	3500	0.59	Functional ≤ 10μM
GRIA4-1-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #1 Of 3), Eukaryotic	Eukaryotes	3500	0.59	Functional ≤ 10μM
GRIK3-1-E	Glutamate Receptor Ionotropic Kainate 3 (cluster #1 Of 1), Eukaryotic	Eukaryotes	3800	0.58	Functional ≤ 10μM
Z104302-1-O	Glutamate NMDA Receptor (cluster #1 Of 7), Other	Other	3500	0.59	Binding ≤ 10μM
Z50597-1-O	Rattus Norvegicus (cluster #1 Of 12), Other	Other	800	0.66	Functional ≤ 10μM
Z50597-1-O	Rattus Norvegicus (cluster #1 Of 12), Other	Other	6700	0.56	Functional ≤ 10μM

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-2.69	-1.72	-76.52	3	6	-1	117	185.159	3	↓ MOL2 SDF SMILES Flexibase

24632618

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Atpa Atpa

Find On: PubMed — Wikipedia — Google

Vendors

And 3 More

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRIA1-1-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #1 Of 4), Eukaryotic	Eukaryotes	2100	0.50	Binding ≤ 10μM
GRIA1-1-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #1 Of 4), Eukaryotic	Eukaryotes	2780	0.49	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	1800	0.50	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	2100	0.50	Binding ≤ 10μM
GRIA3-4-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #4 Of 4), Eukaryotic	Eukaryotes	2100	0.50	Binding ≤ 10μM
GRIA3-4-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #4 Of 4), Eukaryotic	Eukaryotes	7900	0.45	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	2100	0.50	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	7600	0.45	Binding ≤ 10μM
GRIK1-1-E	Glutamate Receptor Ionotropic Kainate 1 (cluster #1 Of 3), Eukaryotic	Eukaryotes	2	0.76	Binding ≤ 10μM
GRIK3-3-E	Glutamate Receptor Ionotropic Kainate 3 (cluster #3 Of 3), Eukaryotic	Eukaryotes	2530	0.49	Binding ≤ 10μM
GRIK5-1-E	Glutamate Receptor Ionotropic Kainate 5 (cluster #1 Of 2), Eukaryotic	Eukaryotes	480	0.55	Binding ≤ 10μM
GRIK1-1-E	Glutamate Receptor Ionotropic Kainate 1 (cluster #1 Of 2), Eukaryotic	Eukaryotes	660	0.54	Functional ≤ 10μM

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-0.97	-0.38	-49.09	3	6	-1	117	227.24	4	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	-0.97	-0.69	-105.71	2	6	-2	115	226.232	4	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	-1.42	1.24	-28.43	4	6	0	114	228.248	4	↓ MOL2 SDF SMILES Flexibase

25725205

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: Atpa Atpa

Find On: PubMed — Wikipedia — Google

Vendors

And 4 More

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRIA1-1-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #1 Of 4), Eukaryotic	Eukaryotes	2100	0.50	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	2100	0.50	Binding ≤ 10μM
GRIA3-4-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #4 Of 4), Eukaryotic	Eukaryotes	2100	0.50	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	2100	0.50	Binding ≤ 10μM

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-0.97	-0.34	-48.46	3	6	-1	117	227.24	4	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	-0.97	-0.64	-107.42	2	6	-2	115	226.232	4	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	-0.97	-0.92	-35.36	4	6	0	114	228.248	4	↓ MOL2 SDF SMILES Flexibase

13766121

Analogs

Draw Identity 99% 90% 80% 70%

Find On: PubMed — Wikipedia — Google

Vendors

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRIA1-2-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #2 Of 4), Eukaryotic	Eukaryotes	65	0.67	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	53	0.68	Binding ≤ 10μM
GRIA3-4-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #4 Of 4), Eukaryotic	Eukaryotes	451	0.59	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	451	0.59	Binding ≤ 10μM
GRIK1-2-E	Glutamate Receptor Ionotropic Kainate 1 (cluster #2 Of 3), Eukaryotic	Eukaryotes	47	0.68	Binding ≤ 10μM
GRIK5-1-E	Glutamate Receptor Ionotropic Kainate 5 (cluster #1 Of 2), Eukaryotic	Eukaryotes	57	0.68	Binding ≤ 10μM
GRIA2-2-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #2 Of 4), Eukaryotic	Eukaryotes	2110	0.53	Functional ≤ 10μM

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-3.35	-0.77	-39.5	4	7	0	123	233.611	3	↓ MOL2 SDF SMILES Flexibase

2047688

Analogs

Draw Identity 99% 90% 80% 70%

Find On: PubMed — Wikipedia — Google

Vendors

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRIA1-2-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #2 Of 4), Eukaryotic	Eukaryotes	163	0.63	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	176	0.63	Binding ≤ 10μM
GRIA3-4-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #4 Of 4), Eukaryotic	Eukaryotes	976	0.56	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	972	0.56	Binding ≤ 10μM
GRIK1-3-E	Glutamate Receptor Ionotropic Kainate 1 (cluster #3 Of 3), Eukaryotic	Eukaryotes	2	0.81	Binding ≤ 10μM
GRIK5-1-E	Glutamate Receptor Ionotropic Kainate 5 (cluster #1 Of 2), Eukaryotic	Eukaryotes	0	0.00	Binding ≤ 10μM
GRIK3-1-E	Glutamate Receptor Ionotropic Kainate 3 (cluster #1 Of 1), Eukaryotic	Eukaryotes	140	0.64	Functional ≤ 10μM

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-2.95	0.82	-42.22	4	7	0	123	325.062	3	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	-2.49	-1.87	-67.59	3	7	-1	126	324.054	3	↓ MOL2 SDF SMILES Flexibase

2530708

Analogs

Draw Identity 99% 90% 80% 70%

Find On: PubMed — Wikipedia — Google

Vendors

And 2 More

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRIA1-2-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #2 Of 4), Eukaryotic	Eukaryotes	15	0.73	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	25	0.71	Binding ≤ 10μM
GRIA3-4-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #4 Of 4), Eukaryotic	Eukaryotes	70	0.67	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	305	0.61	Binding ≤ 10μM
GRIK1-3-E	Glutamate Receptor Ionotropic Kainate 1 (cluster #3 Of 3), Eukaryotic	Eukaryotes	1380	0.55	Binding ≤ 10μM
GRIK5-1-E	Glutamate Receptor Ionotropic Kainate 5 (cluster #1 Of 2), Eukaryotic	Eukaryotes	1820	0.54	Binding ≤ 10μM
GRIA1-2-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #2 Of 3), Eukaryotic	Eukaryotes	382	0.60	Functional ≤ 10μM
GRIA2-2-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #2 Of 4), Eukaryotic	Eukaryotes	463	0.59	Functional ≤ 10μM

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-3.87	-0.19	-45.44	4	7	0	123	217.156	3	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	-3.41	-2.93	-72.07	3	7	-1	126	216.148	3	↓ MOL2 SDF SMILES Flexibase

19850508

Analogs

19850510

Draw Identity 99% 90% 80% 70%

Find On: PubMed — Wikipedia — Google

Vendors

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRIA1-1-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #1 Of 4), Eukaryotic	Eukaryotes	600	0.67	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	600	0.67	Binding ≤ 10μM
GRIA3-4-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #4 Of 4), Eukaryotic	Eukaryotes	600	0.67	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	600	0.67	Binding ≤ 10μM

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-2.68	-0.55	-39.54	3	6	-1	112	185.159	3	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	-2.23	-2.22	-94.17	2	6	-2	115	184.151	3	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	-2.23	-3.13	-40.73	4	6	0	114	186.167	3	↓ MOL2 SDF SMILES Flexibase

19850510

Analogs

19850508

Draw Identity 99% 90% 80% 70%

Find On: PubMed — Wikipedia — Google

Vendors

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRIA1-1-E	Glutamate Receptor Ionotropic, AMPA 1 (cluster #1 Of 4), Eukaryotic	Eukaryotes	600	0.67	Binding ≤ 10μM
GRIA2-4-E	Glutamate Receptor Ionotropic, AMPA 2 (cluster #4 Of 4), Eukaryotic	Eukaryotes	600	0.67	Binding ≤ 10μM
GRIA3-4-E	Glutamate Receptor Ionotropic, AMPA 3 (cluster #4 Of 4), Eukaryotic	Eukaryotes	600	0.67	Binding ≤ 10μM
GRIA4-4-E	Glutamate Receptor Ionotropic, AMPA 4 (cluster #4 Of 5), Eukaryotic	Eukaryotes	600	0.67	Binding ≤ 10μM

Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	-2.68	-0.42	-41.3	3	6	-1	112	185.159	3	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	-2.23	-2.09	-96.11	2	6	-2	115	184.151	3	↓ MOL2 SDF SMILES Flexibase
Lo Low (pH 4.5-6)	-2.23	-3.06	-44.01	4	6	0	114	186.167	3	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

target.name = GRIA3-4-E
target.type = B10
page.format = summary
page.num = 1
filter.purchasability = purchasable

Structural Results Found: (before additional filtering)

SQL Query Was

SELECT DISTINCT(ci.sub_id_fk) AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id INNER JOIN activity AS ac ON ci.sub_id_fk=ac.sub_id_fk INNER JOIN target AS t ON ac.target_fk=t.target_id  WHERE c.free = 1 AND t.code LIKE 'GRIA3-4-E' AND t.atype_fk = 0 AND c.purchasable IN (1,2,4,5)    LIMIT 50

Permalink

//zinc12.docking.org/results/combination?target.name=GRIA3-4-E&target.type=B10&filter.purchasability=purchasable

Embed Link to Results

<div id="zinc-link"></div>
<script type="text/javascript" src="//zinc12.docking.org/js/embed.js"></script>
<script type="text/javascript">
    window.zinc.embed('zinc-link', {
        "target.name": "GRIA3-4-E",        
        "target.type": "B10"        

    });
</script>