ZINC 12

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  ZINC ID or SMILES

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Apollo Scientific

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

Binding 10μM Targets with Highest Number of Available Compounds (59 in total)

Name (Uniprot)	Swissprot	ChEMBL	Description	Size	Browse	Download (Annotations)
CA2D1_MOUSE	O08532	CHEMBL4676	Voltage-gated calcium channel alpha2/delta subunit 1	8	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ACES_HUMAN	P22303	CHEMBL220	Acetylcholinesterase	4	Annotations Catalogs	SMILES SDF Mol2 Flexibase
A3EZI9_9HEPC	A3EZI9	CHEMBL4893	Hepatitis C virus NS3 protease/helicase	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH2_HUMAN	P00918	CHEMBL205	Carbonic anhydrase II	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
EST1_HUMAN	P23141	CHEMBL2265	Acyl coenzyme A:cholesterol acyltransferase	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
PGH1_SHEEP	P05979	CHEMBL2949	Cyclooxygenase-1	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
PGH2_HUMAN	P35354	CHEMBL230	Cyclooxygenase-2	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
TYSY_MOUSE	P07607	CHEMBL3160	Thymidylate synthase	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ANDR_HUMAN	P10275	CHEMBL1871	Androgen Receptor	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH1_HUMAN	P00915	CHEMBL261	Carbonic anhydrase I	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
FABPL_RAT	P02692	CHEMBL5738	Fatty acid-binding protein, liver	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
MGLL_HUMAN	Q99685	CHEMBL4191	Monoglyceride lipase	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
PGH1_HUMAN	P23219	CHEMBL221	Cyclooxygenase-1	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
PGH1_RAT	Q63921	CHEMBL4042	Cyclooxygenase-1	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
PGH2_MOUSE	Q05769	CHEMBL4321	Cyclooxygenase-2	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z104301	Z104301	CHEMBL1907607	GABA-A receptor; anion channel	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT2A_RAT	P14842	CHEMBL322	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_RAT	P08909	CHEMBL324	Serotonin 2c (5-HT2c) receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
A3RLP8_CHV1	A3RLP8	CHEMBL1075062	Thymidine kinase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ACHA7_HUMAN	P36544	CHEMBL2492	Neuronal acetylcholine receptor protein alpha-7 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ADA1A_BOVIN	P18130	CHEMBL4892	Alpha-1a adrenergic receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ADA2A_BOVIN	Q28838	CHEMBL4744	Alpha-2a adrenergic receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
AK1A1_HUMAN	P14550	CHEMBL2246	Aldehyde reductase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
AK1A1_PIG	P50578	CHEMBL4049	Aldehyde reductase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
AK1A1_RAT	P51635	CHEMBL3871	Aldehyde reductase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
AK1BA_HUMAN	O60218	CHEMBL5983	Aldo-keto reductase family 1 member B10	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
ALDR_BOVIN	P16116	CHEMBL3081	Aldose reductase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ALDR_HUMAN	P15121	CHEMBL1900	Aldose reductase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ALDR_PIG	P80276	CHEMBL4559	Aldose reductase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ALDR_RAT	P07943	CHEMBL2622	Aldose reductase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ANDR_RAT	P15207	CHEMBL3072	Androgen Receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CCNH_HUMAN	P51946	CHEMBL2165	Cyclin H	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CDK7_HUMAN	P50613	CHEMBL3055	Cyclin-dependent kinase 7	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
DHB3_HUMAN	P37058	CHEMBL4234	Estradiol 17-beta-dehydrogenase 3	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
EST1_RABIT	P12337	CHEMBL2623	Acyl coenzyme A:cholesterol acyltransferase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
EST2_HUMAN	O00748	CHEMBL3180	Carboxylesterase 2	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA1_HUMAN	P14867	CHEMBL1962	GABA receptor alpha-1 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA2_HUMAN	P47869	CHEMBL4956	GABA receptor alpha-2 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA3_HUMAN	P34903	CHEMBL3026	GABA receptor alpha-3 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA4_HUMAN	P48169	CHEMBL2472	GABA receptor alpha-4 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA5_HUMAN	P31644	CHEMBL5112	GABA receptor alpha-5 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA6_HUMAN	Q16445	CHEMBL2579	GABA receptor alpha-6 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GPR44_HUMAN	Q9Y5Y4	CHEMBL5071	G protein-coupled receptor 44	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GSK3B_HUMAN	P49841	CHEMBL262	Glycogen synthase kinase-3 beta	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
I23O1_HUMAN	P14902	CHEMBL4685	Indoleamine 2,3-dioxygenase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
IKKB_HUMAN	O14920	CHEMBL1991	Inhibitor of nuclear factor kappa B kinase beta subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
KIF11_HUMAN	P52732	CHEMBL4581	Kinesin-like protein 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
MAT1_HUMAN	P51948	CHEMBL5053	CDK-activating kinase assembly factor MAT1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
P90584_PLAFA	P90584	CHEMBL4090	Protein kinase Pfmrk	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
PERM_HUMAN	P05164	CHEMBL2439	Myeloperoxidase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
PTR1_LEIMA	Q01782	CHEMBL6194	Pteridine reductase 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
TRXR2_PLAF7	P61076	CHEMBL4547	Thioredoxin reductase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
TRY1_HUMAN	P07477	CHEMBL209	Trypsin I	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
TTHY_HUMAN	P02766	CHEMBL3194	Transthyretin	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
VCAM1_HUMAN	P19320	CHEMBL3735	Vascular cell adhesion protein 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z104283	Z104283	CHEMBL1907589	Neuronal acetylcholine receptor; alpha4/beta2	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase