ZINC 12

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Quick Search ZINC ID or SMILES

Results
Query Details

Page Size:

Format: Representations: Purchasability:

ZINC Item

Suppliers, Protomers, & Similar Substances

58593499

Analogs

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Vendors

And 1 More

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRM4-1-E	Metabotropic Glutamate Receptor 4 (cluster #1 Of 3), Eukaryotic	Eukaryotes	1000	0.56	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)	2.43	6.99	-7.15	2	3	0	52	197.241	2	↓ MOL2 SDF SMILES Flexibase

66076277

Analogs

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Vendors

American Custom Chemicals Corp.
- HCH0316618
Chembo Pharma
- KB-69606

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRM4-1-E	Metabotropic Glutamate Receptor 4 (cluster #1 Of 3), Eukaryotic	Eukaryotes	517	0.34	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)	3.78	7.94	-13.36	2	5	0	71	386.238	4	↓ MOL2 SDF SMILES Flexibase

362766

Analogs

2910503
5269327
33816974
33816975

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Popular Name: N/A N/A

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Vendors

And 3 More

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRM4-1-E	Metabotropic Glutamate Receptor 4 (cluster #1 Of 3), Eukaryotic	Eukaryotes	1100	0.52	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)	2.31	-0.67	-9.5	1	3	0	42	232.67	2	↓ MOL2 SDF SMILES Flexibase

171065

Analogs

24218367
36737195

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Vendors

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRM4-1-E	Metabotropic Glutamate Receptor 4 (cluster #1 Of 3), Eukaryotic	Eukaryotes	500	0.49	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)	1.55	3.45	-11.97	1	5	0	60	242.234	2	↓ MOL2 SDF SMILES Flexibase

3326915

Analogs

33816974

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Notice: Undefined index: field_name in /domains/zinc12/htdocs/lib/zinc/reporter/ZincAuxiliaryInfoReports.php on line 244

Notice: Undefined index: synonym in /domains/zinc12/htdocs/lib/zinc/reporter/ZincAuxiliaryInfoReports.php on line 245

Popular Name:

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Vendors

And 10 More

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRM4-1-E	Metabotropic Glutamate Receptor 4 (cluster #1 Of 3), Eukaryotic	Eukaryotes	1100	0.46	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)	2.32	-0.59	-11.1	1	4	0	51	262.696	3	↓ MOL2 SDF SMILES Flexibase

43122151

Analogs

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Popular Name: VU 0361737 VU 0361737

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Vendors

And 5 More

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRM4-1-E	Metabotropic Glutamate Receptor 4 (cluster #1 Of 3), Eukaryotic	Eukaryotes	240	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)	2.32	4.65	-8.93	1	4	0	51	262.696	3	↓ MOL2 SDF SMILES Flexibase

7306536

Analogs

37009848

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Vendors

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRM4-1-E	Metabotropic Glutamate Receptor 4 (cluster #1 Of 3), Eukaryotic	Eukaryotes	2100	0.40	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)	3.16	1.42	-7.04	1	3	0	41	300.667	3	↓ MOL2 SDF SMILES Flexibase

3157772

Analogs

24257875

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Vendors

And 5 More

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRM4-1-E	Metabotropic Glutamate Receptor 4 (cluster #1 Of 3), Eukaryotic	Eukaryotes	1800	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)	2.53	1.65	-10.41	1	3	0	41	266.222	3	↓ MOL2 SDF SMILES Flexibase

3331176

Analogs

24266294
36737999
36738021

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Popular Name:

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Vendors

And 11 More

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRM4-1-E	Metabotropic Glutamate Receptor 4 (cluster #1 Of 3), Eukaryotic	Eukaryotes	2400	0.41	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)	1.30	4	-11.08	1	5	0	60	258.277	4	↓ MOL2 SDF SMILES Flexibase

4084933

Analogs

12959448

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Vendors

And 1 More

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRM4-1-E	Metabotropic Glutamate Receptor 4 (cluster #1 Of 3), Eukaryotic	Eukaryotes	7800	0.48	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)	2.62	7.73	-25.05	1	2	0	29	214.293	2	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	3.34	7.39	-52.15	0	2	-1	26	213.285	2	↓ MOL2 SDF SMILES Flexibase

34327129

Analogs

3887966

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Vendors

American Custom Chemicals Corp.
- NEW0093543
AKOS (make-on-demand)
- AKOS000279071

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRM4-1-E	Metabotropic Glutamate Receptor 4 (cluster #1 Of 3), Eukaryotic	Eukaryotes	5800	0.49	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)	2.97	6.92	-28.96	3	2	1	40	197.261	2	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	2.97	6.56	-6.19	2	2	0	39	196.253	2	↓ MOL2 SDF SMILES Flexibase

45951686

Analogs

31891180

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Vendors

And 9 More

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRM4-1-E	Metabotropic Glutamate Receptor 4 (cluster #1 Of 3), Eukaryotic	Eukaryotes	4900	0.46	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)	1.94	6.07	-8.05	2	4	0	65	211.224	1	↓ MOL2 SDF SMILES Flexibase

58602679

Analogs

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Vendors

Innovapharm BB Make on Demand
- BBV-00077591

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRM4-1-E	Metabotropic Glutamate Receptor 4 (cluster #1 Of 3), Eukaryotic	Eukaryotes	4500	0.47	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)	2.60	7.06	-7.56	2	3	0	52	215.231	2	↓ MOL2 SDF SMILES Flexibase

58599618

Analogs

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Vendors

Innovapharm BB Make on Demand
- BBV-00077597

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRM4-1-E	Metabotropic Glutamate Receptor 4 (cluster #1 Of 3), Eukaryotic	Eukaryotes	4100	0.54	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)	2.15	6.18	-6.43	2	3	0	52	203.27	2	↓ MOL2 SDF SMILES Flexibase

58575561

Analogs

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Vendors

Innovapharm BB Make on Demand
- BBV-00077596

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRM4-1-E	Metabotropic Glutamate Receptor 4 (cluster #1 Of 3), Eukaryotic	Eukaryotes	9400	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)	1.51	5.22	-7.45	2	4	0	65	187.202	2	↓ MOL2 SDF SMILES Flexibase

5029798

Analogs

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Vendors

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRM4-1-E	Metabotropic Glutamate Receptor 4 (cluster #1 Of 3), Eukaryotic	Eukaryotes	4100	0.36	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)	3.31	5.28	-13.37	2	5	0	70	278.315	3	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	3.31	6.05	-58.67	1	5	-1	73	277.307	3	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	3.31	5.72	-37.99	3	5	1	72	279.323	3	↓ MOL2 SDF SMILES Flexibase

4764850

Analogs

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Vendors

And 2 More

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRM4-1-E	Metabotropic Glutamate Receptor 4 (cluster #1 Of 3), Eukaryotic	Eukaryotes	1700	0.38	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)	2.89	4.94	-14.17	2	5	0	70	278.315	3	↓ MOL2 SDF SMILES Flexibase

3065515

Analogs

33816974
33816975

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Vendors

And 7 More

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRM4-1-E	Metabotropic Glutamate Receptor 4 (cluster #1 Of 3), Eukaryotic	Eukaryotes	1400	0.48	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)	2.94	-0.79	-8.84	1	3	0	41	267.115	2	↓ MOL2 SDF SMILES Flexibase

43070991

Analogs

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Vendors

Otava (Virtual)
- 4491456

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
GRM4-1-E	Metabotropic Glutamate Receptor 4 (cluster #1 Of 3), Eukaryotic	Eukaryotes	2800	0.46	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)	2.43	5.57	-7.93	1	4	0	55	268.103	2	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

target.name = GRM4-1-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 'GRM4-1-E' AND t.atype_fk = 0 AND c.purchasable IN (1,2,4,5)    LIMIT 50

Permalink

//zinc12.docking.org/results/combination?target.name=GRM4-1-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": "GRM4-1-E",        
        "target.type": "B10"        

    });
</script>