ZINC 12

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  ZINC ID or SMILES

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HMDB Microbe

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

Binding 10μM Targets with Highest Number of Available Compounds (61 in total)

Name (Uniprot)	Swissprot	ChEMBL	Description	Size	Browse	Download (Annotations)
CAH12_HUMAN	O43570	CHEMBL3242	Carbonic anhydrase XII	6	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH1_HUMAN	P00915	CHEMBL261	Carbonic anhydrase I	6	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH2_HUMAN	P00918	CHEMBL205	Carbonic anhydrase II	6	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH6_HUMAN	P23280	CHEMBL3025	Carbonic anhydrase VI	6	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH9_HUMAN	Q16790	CHEMBL3594	Carbonic anhydrase IX	6	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH14_HUMAN	Q9ULX7	CHEMBL3510	Carbonic anhydrase XIV	5	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH5A_HUMAN	P35218	CHEMBL4789	Carbonic anhydrase VA	5	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH7_HUMAN	P43166	CHEMBL2326	Carbonic anhydrase VII	5	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH3_HUMAN	P07451	CHEMBL2885	Carbonic anhydrase III	4	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH4_HUMAN	P22748	CHEMBL3729	Carbonic anhydrase IV	4	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH5B_HUMAN	Q9Y2D0	CHEMBL3969	Carbonic anhydrase VB	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ACES_HUMAN	P22303	CHEMBL220	Acetylcholinesterase	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH13_MOUSE	Q9D6N1	CHEMBL2186	Carbonic anhydrase XIII	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH15_MOUSE	Q99N23	CHEMBL5973	Carbonic anhydrase 15	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
EGLN1_HUMAN	Q9GZT9	CHEMBL5697	Egl nine homolog 1	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ACH10_RAT	Q9JLB5	CHEMBL3461	Neuronal acetylcholine receptor protein alpha-10 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ACHA3_RAT	P04757	CHEMBL3818	Neuronal acetylcholine receptor protein alpha-3 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ACHA4_RAT	P09483	CHEMBL307	Neuronal acetylcholine receptor protein alpha-4 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ALDR_HUMAN	P15121	CHEMBL1900	Aldose reductase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
FYN_HUMAN	P06241	CHEMBL1841	Tyrosine-protein kinase FYN	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRIA1_HUMAN	P42261	CHEMBL2009	Glutamate receptor ionotropic, AMPA 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRIA1_MOUSE	P23818	CHEMBL3502	Glutamate receptor ionotropic, AMPA 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRIA2_HUMAN	P42262	CHEMBL4016	Glutamate receptor ionotropic, AMPA 2	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRIA2_RAT	P19491	CHEMBL3503	Glutamate receptor ionotropic, AMPA 2	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRIA3_RAT	P19492	CHEMBL3504	Glutamate receptor ionotropic, AMPA 3	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRIA4_HUMAN	P48058	CHEMBL3190	Glutamate receptor ionotropic, AMPA 4	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRIA4_RAT	P19493	CHEMBL3505	Glutamate receptor ionotropic, AMPA 4	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRIK1_HUMAN	P39086	CHEMBL1918	Glutamate receptor ionotropic kainate 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRIK1_RAT	P22756	CHEMBL2919	Glutamate receptor ionotropic kainate 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRIK2_HUMAN	Q13002	CHEMBL3683	Glutamate receptor ionotropic kainate 2	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRIK2_RAT	P42260	CHEMBL3607	Glutamate receptor ionotropic kainate 2	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRIK3_HUMAN	Q13003	CHEMBL3684	Glutamate receptor ionotropic kainate 3	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRIK3_RAT	P42264	CHEMBL3744	Glutamate receptor ionotropic kainate 3	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRIK4_RAT	Q01812	CHEMBL3044	Glutamate receptor ionotropic kainate 4	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRIK5_HUMAN	Q16478	CHEMBL2675	Glutamate receptor ionotropic kainate 5	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRIK5_RAT	Q63273	CHEMBL4041	Glutamate receptor ionotropic kainate 5	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRM1_HUMAN	Q13255	CHEMBL3772	Metabotropic glutamate receptor 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRM1_RAT	P23385	CHEMBL4477	Metabotropic glutamate receptor 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRM2_HUMAN	Q14416	CHEMBL5137	Metabotropic glutamate receptor 2	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRM2_RAT	P31421	CHEMBL2851	Metabotropic glutamate receptor 2	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRM3_HUMAN	Q14832	CHEMBL2888	Metabotropic glutamate receptor 3	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRM3_RAT	P31422	CHEMBL3067	Metabotropic glutamate receptor 3	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRM4_HUMAN	Q14833	CHEMBL2736	Metabotropic glutamate receptor 4	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRM5_HUMAN	P41594	CHEMBL3227	Metabotropic glutamate receptor 5	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRM5_RAT	P31424	CHEMBL2564	Metabotropic glutamate receptor 5	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRM6_HUMAN	O15303	CHEMBL4573	Metabotropic glutamate receptor 6	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
HCAR2_HUMAN	Q8TDS4	CHEMBL3785	Nicotinic acid receptor 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
HDAC3_HUMAN	O15379	CHEMBL1829	Histone deacetylase 3	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
LCK_HUMAN	P06239	CHEMBL258	Tyrosine-protein kinase LCK	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
MURI_HELPY	P56068	CHEMBL6078	Glutamate racemase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMDE1_RAT	Q00959	CHEMBL310	Glutamate [NMDA] receptor subunit epsilon 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMDE2_RAT	Q00960	CHEMBL311	Glutamate [NMDA] receptor subunit epsilon 2	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMDE3_RAT	Q00961	CHEMBL401	Glutamate [NMDA] receptor subunit epsilon 3	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMDE4_RAT	Q62645	CHEMBL303	Glutamate [NMDA] receptor subunit epsilon 4	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Q2PCB5_DICLA	Q2PCB5	CHEMBL1795125	Carbonic anhydrase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Q3I4V7_CRYNV	Q3I4V7	CHEMBL1697676	Carbonic anhydrase 2	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Q5AJ71_CANAL	Q5AJ71	CHEMBL5337	Carbonic anhydrase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Q6RY99_RAT	Q6RY99	CHEMBL3558	Gamma-hydroxybutyrate receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Q81VW8_BACAN	Q81VW8	CHEMBL1075045	Dihydropteroate synthase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
S22A6_MOUSE	Q8VC69	CHEMBL5653	Solute carrier family 22 member 6	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z104302	Z104302	CHEMBL1907608	Glutamate NMDA receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase