ZINC 12

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  ZINC ID or SMILES

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Binding 10μM Binding 1μM Functional 10μM ADME/T 10μM

Binding 1μM Targets with Highest Number of Available Compounds (61 in total)

Name (Uniprot)	Swissprot	ChEMBL	Description	Size	Browse	Download (Annotations)
CA2D1_MOUSE	O08532	CHEMBL4676	Voltage-gated calcium channel alpha2/delta subunit 1	5	Annotations Catalogs	SMILES SDF Mol2 Flexibase
AMPM_ECOLI	P0AE18	CHEMBL3423	Methionine aminopeptidase	4	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GSK3B_HUMAN	P49841	CHEMBL262	Glycogen synthase kinase-3 beta	4	Annotations Catalogs	SMILES SDF Mol2 Flexibase
THRB_HUMAN	P00734	CHEMBL204	Thrombin	4	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT1B_RAT	P28564	CHEMBL3459	Serotonin 1b (5-HT1b) receptor	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT1A_HUMAN	P08908	CHEMBL214	Serotonin 1a (5-HT1a) receptor	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT1A_RAT	P19327	CHEMBL273	Serotonin 1a (5-HT1a) receptor	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT1D_HUMAN	P28221	CHEMBL1983	Serotonin 1d (5-HT1d) receptor	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT2A_RAT	P14842	CHEMBL322	Serotonin 2a (5-HT2a) receptor	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT2C_RAT	P08909	CHEMBL324	Serotonin 2c (5-HT2c) receptor	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT3A_RAT	P35563	CHEMBL2411	Serotonin 3a (5-HT3a) receptor	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT3B_RAT	Q9JJ16	CHEMBL3458	Serotonin 3b (5-HT3b) receptor	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT6R_HUMAN	P50406	CHEMBL3371	Serotonin 6 (5-HT6) receptor	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ACHA7_HUMAN	P36544	CHEMBL2492	Neuronal acetylcholine receptor protein alpha-7 subunit	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ADA1A_BOVIN	P18130	CHEMBL4892	Alpha-1a adrenergic receptor	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ADA2A_BOVIN	Q28838	CHEMBL4744	Alpha-2a adrenergic receptor	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GYRA_ECOLI	P0AES4	CHEMBL1858	DNA gyrase subunit A	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GYRB_ECOLI	P0AES6	CHEMBL1826	DNA gyrase subunit B	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z104283	Z104283	CHEMBL1907589	Neuronal acetylcholine receptor; alpha4/beta2	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT1B_HUMAN	P28222	CHEMBL1898	Serotonin 1b (5-HT1b) receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT1D_RAT	P28565	CHEMBL5450	Serotonin 1d (5-HT1d) receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT1F_RAT	P30940	CHEMBL4646	Serotonin 1f (5-HT1f) receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT2A_HUMAN	P28223	CHEMBL224	Serotonin 2a (5-HT2a) receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT2B_RAT	P30994	CHEMBL323	Serotonin 2b (5-HT2b) receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT2C_HUMAN	P28335	CHEMBL225	Serotonin 2c (5-HT2c) receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT4R_HUMAN	Q13639	CHEMBL1875	Serotonin 4 (5-HT4) receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT7R_HUMAN	P34969	CHEMBL3155	Serotonin 7 (5-HT7) receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
A3EZI9_9HEPC	A3EZI9	CHEMBL4893	Hepatitis C virus NS3 protease/helicase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
A4_HUMAN	P05067	CHEMBL2487	Beta amyloid A4 protein	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ACM1_HUMAN	P11229	CHEMBL216	Muscarinic acetylcholine receptor M1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
AK1C2_HUMAN	P52895	CHEMBL5847	Aldo-keto reductase family 1 member C2	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
AK1C3_HUMAN	P42330	CHEMBL4681	Aldo-keto-reductase family 1 member C3	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CATK_HUMAN	P43235	CHEMBL268	Cathepsin K	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CDK2_HUMAN	P24941	CHEMBL301	Cyclin-dependent kinase 2	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CLK1_HUMAN	P49759	CHEMBL4224	Dual specificty protein kinase CLK1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CSF1R_HUMAN	P07333	CHEMBL1844	Macrophage colony stimulating factor receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
DRTS_PLAFK	P13922	CHEMBL1939	Dihydrofolate reductase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
DYR1A_RAT	Q63470	CHEMBL5508	Dual specificity tyrosine-phosphorylation-regulated kinase 1A	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
EST1_HUMAN	P23141	CHEMBL2265	Acyl coenzyme A:cholesterol acyltransferase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
FA10_HUMAN	P00742	CHEMBL244	Coagulation factor X	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GSK3A_HUMAN	P49840	CHEMBL2850	Glycogen synthase kinase-3 alpha	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
HCAR2_HUMAN	Q8TDS4	CHEMBL3785	Nicotinic acid receptor 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
HCAR2_RAT	Q80Z39	CHEMBL4731	HM74 nicotinic acid GPCR	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
HDAC2_HUMAN	Q92769	CHEMBL1937	Histone deacetylase 2	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
I23O1_MOUSE	P28776	CHEMBL1075294	Indoleamine 2,3-dioxygenase 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
KCNN3_RAT	P70605	CHEMBL3780	Small conductance calcium-activated potassium channel protein 3	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
MK08_HUMAN	P45983	CHEMBL2276	c-Jun N-terminal kinase 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
MTR1A_CHICK	P49285	CHEMBL4555	Melatonin receptor 1A	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
MTR1B_CHICK	P51050	CHEMBL4466	Melatonin receptor 1B	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
MTR1C_CHICK	P49288	CHEMBL3196	Melatonin receptor 1C	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMDZ1_RAT	P35439	CHEMBL330	Glutamate (NMDA) receptor subunit zeta 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
OXDA_HUMAN	P14920	CHEMBL5485	D-amino-acid oxidase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
OXDA_RAT	O35078	CHEMBL5756	D-amino-acid oxidase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
PDE4B_HUMAN	Q07343	CHEMBL275	Phosphodiesterase 4B	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
PERM_HUMAN	P05164	CHEMBL2439	Myeloperoxidase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
PNPH_BOVIN	P55859	CHEMBL2935	Purine nucleoside phosphorylase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
PNPH_HUMAN	P00491	CHEMBL4338	Purine nucleoside phosphorylase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
PNPH_RAT	P85973	CHEMBL2395	Purine-nucleoside phosphorylase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
SC6A2_HUMAN	P23975	CHEMBL222	Norepinephrine transporter	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
TRY1_BOVIN	P00760	CHEMBL3769	Trypsin I	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
TRY1_HUMAN	P07477	CHEMBL209	Trypsin I	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase