ZINC 12

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  ZINC ID or SMILES

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DrugBank-Street Drugs

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

Binding 1μM Targets with Highest Number of Available Compounds (129 in total)

Name (Uniprot)	Swissprot	ChEMBL	Description	Size	Browse	Download (Annotations)
OPRM_RAT	P33535	CHEMBL270	Mu opioid receptor	15	Annotations Catalogs	SMILES SDF Mol2 Flexibase
OPRD_RAT	P33533	CHEMBL269	Delta opioid receptor	14	Annotations Catalogs	SMILES SDF Mol2 Flexibase
SGMR1_RAT	Q9R0C9	CHEMBL3602	Sigma opioid receptor	14	Annotations Catalogs	SMILES SDF Mol2 Flexibase
OPRK_RAT	P34975	CHEMBL3614	Kappa opioid receptor	13	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT2A_RAT	P14842	CHEMBL322	Serotonin 2a (5-HT2a) receptor	11	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT2C_RAT	P08909	CHEMBL324	Serotonin 2c (5-HT2c) receptor	11	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT2B_RAT	P30994	CHEMBL323	Serotonin 2b (5-HT2b) receptor	10	Annotations Catalogs	SMILES SDF Mol2 Flexibase
OPRK_HUMAN	P41145	CHEMBL237	Kappa opioid receptor	10	Annotations Catalogs	SMILES SDF Mol2 Flexibase
OPRD_HUMAN	P41143	CHEMBL236	Delta opioid receptor	9	Annotations Catalogs	SMILES SDF Mol2 Flexibase
OPRM_HUMAN	P35372	CHEMBL233	Mu opioid receptor	9	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA1_HUMAN	P14867	CHEMBL1962	GABA receptor alpha-1 subunit	7	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA2_HUMAN	P47869	CHEMBL4956	GABA receptor alpha-2 subunit	7	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA3_HUMAN	P34903	CHEMBL3026	GABA receptor alpha-3 subunit	7	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA5_HUMAN	P31644	CHEMBL5112	GABA receptor alpha-5 subunit	7	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT1A_RAT	P19327	CHEMBL273	Serotonin 1a (5-HT1a) receptor	6	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRB3_HUMAN	P28472	CHEMBL1847	GABA receptor beta-3 subunit	6	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRG2_HUMAN	P18507	CHEMBL1788	GABA receptor gamma-2 subunit	6	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT2A_HUMAN	P28223	CHEMBL224	Serotonin 2a (5-HT2a) receptor	5	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z104301	Z104301	CHEMBL1907607	GABA-A receptor; anion channel	5	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRB2_HUMAN	P47870	CHEMBL1920	GABA receptor beta-2 subunit	4	Annotations Catalogs	SMILES SDF Mol2 Flexibase
OPRK_CAVPO	P41144	CHEMBL3952	Kappa opioid receptor	4	Annotations Catalogs	SMILES SDF Mol2 Flexibase
SC6A2_HUMAN	P23975	CHEMBL222	Norepinephrine transporter	4	Annotations Catalogs	SMILES SDF Mol2 Flexibase
SC6A4_HUMAN	P31645	CHEMBL228	Serotonin transporter	4	Annotations Catalogs	SMILES SDF Mol2 Flexibase
SC6A4_RAT	P31652	CHEMBL313	Serotonin transporter	4	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT2C_HUMAN	P28335	CHEMBL225	Serotonin 2c (5-HT2c) receptor	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ANDR_HUMAN	P10275	CHEMBL1871	Androgen Receptor	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA1_BOVIN	P08219	CHEMBL3627	GABA receptor alpha-1 subunit	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA2_BOVIN	P10063	CHEMBL2321	GABA receptor alpha-2 subunit	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA3_BOVIN	P10064	CHEMBL3628	GABA receptor alpha-3 subunit	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA4_BOVIN	P20237	CHEMBL3140	GABA receptor alpha-4 subunit	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA4_HUMAN	P48169	CHEMBL2472	GABA receptor alpha-4 subunit	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA6_HUMAN	Q16445	CHEMBL2579	GABA receptor alpha-6 subunit	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRB1_BOVIN	P08220	CHEMBL2848	GABA receptor beta-1 subunit	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRB1_HUMAN	P18505	CHEMBL4558	GABA receptor beta-1 subunit	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRD_HUMAN	O14764	CHEMBL3591	GABA receptor delta subunit	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRE_HUMAN	P78334	CHEMBL4635	GABA receptor epsilon subunit	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRG1_HUMAN	Q8N1C3	CHEMBL4044	GABA receptor gamma-1 subunit	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRG2_BOVIN	P22300	CHEMBL5138	GABA receptor gamma-2 subunit	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRG3_HUMAN	Q99928	CHEMBL2739	GABA receptor gamma-3 subunit	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRP_HUMAN	O00591	CHEMBL3506	GABA receptor pi subunit	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRT_HUMAN	Q9UN88	CHEMBL2843	GABA receptor theta subunit	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
OPRM_CAVPO	P97266	CHEMBL4354	Mu opioid receptor	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
OPRM_MOUSE	P42866	CHEMBL2858	Mu opioid receptor	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT1A_HUMAN	P08908	CHEMBL214	Serotonin 1a (5-HT1a) receptor	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
AOFA_RAT	P21396	CHEMBL3358	Monoamine oxidase A	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ESR1_HUMAN	P03372	CHEMBL206	Estrogen receptor alpha	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ESR2_HUMAN	Q92731	CHEMBL242	Estrogen receptor beta	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA2_RAT	P23576	CHEMBL341	GABA receptor alpha-2 subunit	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
OPRD_MOUSE	P32300	CHEMBL3222	Delta opioid receptor	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
PCP_HUMAN	P42785	CHEMBL2335	Lysosomal Pro-X carboxypeptidase	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Q9WTR4_RAT	Q9WTR4	CHEMBL304	Norepinephrine transporter	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
SC6A3_HUMAN	Q01959	CHEMBL238	Dopamine transporter	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
TSPO_RAT	P16257	CHEMBL4552	Peripheral-type benzodiazepine receptor	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z104302	Z104302	CHEMBL1907608	Glutamate NMDA receptor	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT1B_RAT	P28564	CHEMBL3459	Serotonin 1b (5-HT1b) receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT2B_HUMAN	P41595	CHEMBL1833	Serotonin 2b (5-HT2b) receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT6R_HUMAN	P50406	CHEMBL3371	Serotonin 6 (5-HT6) receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
A2AIR5_MOUSE	A2AIR5	CHEMBL2562	Glutamate [NMDA] receptor subunit 3A	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
A2AMW3_MOUSE	A2AMW3	CHEMBL3121	GABA receptor epsilon subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
AA3R_HUMAN	P33765	CHEMBL256	Adenosine A3 receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CA2D1_HUMAN	P54289	CHEMBL1919	Voltage-gated calcium channel alpha2/delta subunit 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CA2D1_RAT	P54290	CHEMBL3420	Voltage-gated calcium channel alpha2/delta subunit 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CA2D2_HUMAN	Q9NY47	CHEMBL3896	Voltage-gated calcium channel alpha2/delta subunit 2	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CA2D2_RAT	Q8CFG6	CHEMBL3914	Voltage-gated calcium channel alpha2/delta subunit 2	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CA2D3_HUMAN	Q8IZS8	CHEMBL3763	Voltage-gated calcium channel alpha2/delta subunit 3	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CA2D3_RAT	Q8CFG5	CHEMBL3281	Voltage-gated calcium channel alpha2/delta subunit 3	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CA2D4_HUMAN	Q7Z3S7	CHEMBL5376	Voltage-gated calcium channel alpha2/delta-4 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CHLE_MOUSE	Q03311	CHEMBL2528	Butyrylcholinesterase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CNR1_HUMAN	P21554	CHEMBL218	Cannabinoid CB1 receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CNR1_MOUSE	P47746	CHEMBL3037	Cannabinoid CB1 receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CNR1_RAT	P20272	CHEMBL3571	Cannabinoid CB1 receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CNR2_HUMAN	P34972	CHEMBL253	Cannabinoid CB2 receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CNR2_MOUSE	P47936	CHEMBL5373	Cannabinoid CB2 receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CNR2_RAT	Q9QZN9	CHEMBL2470	Cannabinoid CB2 receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CP19A_HUMAN	P11511	CHEMBL1978	Cytochrome P450 19A1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
DHB3_HUMAN	P37058	CHEMBL4234	Estradiol 17-beta-dehydrogenase 3	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
FABPL_RAT	P02692	CHEMBL5738	Fatty acid-binding protein, liver	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA1_MOUSE	P62812	CHEMBL3139	GABA receptor alpha-1 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA1_RAT	P62813	CHEMBL343	GABA receptor alpha-1 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA2_MOUSE	P26048	CHEMBL2705	GABA receptor alpha-2 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA3_MOUSE	P26049	CHEMBL3387	GABA receptor alpha-3 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA3_RAT	P20236	CHEMBL328	GABA receptor alpha-3 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA4_MOUSE	Q9D6F4	CHEMBL4182	GABA receptor alpha-4 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA4_RAT	P28471	CHEMBL292	GABA receptor alpha-4 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA5_MOUSE	Q8BHJ7	CHEMBL2304	GABA receptor alpha-5 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA5_RAT	P19969	CHEMBL300	GABA receptor alpha-5 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA6_MOUSE	P16305	CHEMBL4710	GABA receptor alpha-6 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRA6_RAT	P30191	CHEMBL293	GABA receptor alpha-6 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRB1_MOUSE	P50571	CHEMBL2839	GABA receptor beta-1 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRB1_RAT	P15431	CHEMBL334	GABA receptor beta-1 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRB2_RAT	P63138	CHEMBL295	GABA receptor beta-2 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRB3_MOUSE	P63080	CHEMBL4231	GABA receptor beta-3 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRB3_RAT	P63079	CHEMBL316	GABA receptor beta-3 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRD_MOUSE	P22933	CHEMBL3907	GABA receptor delta subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRD_RAT	P18506	CHEMBL337	GABA receptor delta subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRE_RAT	Q9ES14	CHEMBL306	GABA receptor epsilon subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRG1_MOUSE	Q9R0Y8	CHEMBL2891	GABA receptor gamma-1 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRG1_RAT	P23574	CHEMBL296	GABA receptor gamma-1 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRG2_MOUSE	P22723	CHEMBL2941	GABA receptor gamma-2 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRG2_RAT	P18508	CHEMBL297	GABA receptor gamma-2 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRG3_MOUSE	P27681	CHEMBL4236	GABA receptor gamma-3 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRG3_RAT	P28473	CHEMBL336	GABA receptor gamma-3 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRP_MOUSE	Q8QZW7	CHEMBL2746	GABA receptor pi subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRR1_RAT	P50572	CHEMBL3588	GABA receptor rho-1 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRT_MOUSE	Q9JLF1	CHEMBL3249	GABA receptor theta subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMD3A_HUMAN	Q8TCU5	CHEMBL4787	Glutamate [NMDA] receptor subunit 3A	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMD3B_HUMAN	O60391	CHEMBL2913	Glutamate [NMDA] receptor subunit 3B	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMD3B_MOUSE	Q91ZU9	CHEMBL2557	Glutamate [NMDA] receptor subunit 3B	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMDE1_HUMAN	Q12879	CHEMBL1972	Glutamate [NMDA] receptor subunit epsilon 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMDE1_MOUSE	P35436	CHEMBL2521	Glutamate [NMDA] receptor subunit epsilon 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMDE2_HUMAN	Q13224	CHEMBL1904	Glutamate [NMDA] receptor subunit epsilon 2	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMDE2_MOUSE	Q01097	CHEMBL3442	Glutamate [NMDA] receptor subunit epsilon 2	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMDE3_HUMAN	Q14957	CHEMBL4109	Glutamate [NMDA] receptor subunit epsilon 3	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMDE3_MOUSE	Q01098	CHEMBL3555	Glutamate [NMDA] receptor subunit epsilon 3	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_HUMAN	O15399	CHEMBL2591	Glutamate [NMDA] receptor subunit epsilon 4	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMDE4_MOUSE	Q03391	CHEMBL2893	Glutamate [NMDA] receptor subunit epsilon 4	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMDZ1_HUMAN	Q05586	CHEMBL2015	Glutamate (NMDA) receptor subunit zeta 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMDZ1_MOUSE	P35438	CHEMBL2895	Glutamate (NMDA) receptor subunit zeta 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMDZ1_RAT	P35439	CHEMBL330	Glutamate (NMDA) receptor subunit zeta 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
O77773_PIG	O77773	CHEMBL3985	Voltage-dependent calcium channel alpha2delta subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
OPRM_MACMU	Q9MYW9	CHEMBL5799	Mu-type opioid receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
OPRX_HUMAN	P41146	CHEMBL2014	Nociceptin receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Q91ZM7_RAT	Q91ZM7	CHEMBL305	GABA receptor theta subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
S5A2_HUMAN	P31213	CHEMBL1856	Steroid 5-alpha-reductase 2	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
SC6A3_RAT	P23977	CHEMBL338	Dopamine transporter	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
SGMR1_HUMAN	Q99720	CHEMBL287	Sigma opioid receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50594	Z50594	CHEMBL375	Mus musculus	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50597	Z50597	CHEMBL376	Rattus norvegicus	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase