ZINC 12

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  ZINC ID or SMILES

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Rare Chemicals

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

Binding 10μM Targets with Highest Number of Available Compounds (99 in total)

Name (Uniprot)	Swissprot	ChEMBL	Description	Size	Browse	Download (Annotations)
CAH2_HUMAN	P00918	CHEMBL205	Carbonic anhydrase II	4	Annotations Catalogs	SMILES SDF Mol2 Flexibase
OPRD_HUMAN	P41143	CHEMBL236	Delta opioid receptor	4	Annotations Catalogs	SMILES SDF Mol2 Flexibase
OPRK_HUMAN	P41145	CHEMBL237	Kappa opioid receptor	4	Annotations Catalogs	SMILES SDF Mol2 Flexibase
OPRM_HUMAN	P35372	CHEMBL233	Mu opioid receptor	4	Annotations Catalogs	SMILES SDF Mol2 Flexibase
OPRM_RAT	P33535	CHEMBL270	Mu 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
CAH1_HUMAN	P00915	CHEMBL261	Carbonic anhydrase I	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CP19A_HUMAN	P11511	CHEMBL1978	Cytochrome P450 19A1	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
TYRO_AGABI	O42713	CHEMBL3318	Tyrosinase	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT3A_HUMAN	P46098	CHEMBL1899	Serotonin 3a (5-HT3a) receptor	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
AMPM_ECOLI	P0AE18	CHEMBL3423	Methionine aminopeptidase	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CA2D1_MOUSE	O08532	CHEMBL4676	Voltage-gated calcium channel alpha2/delta subunit 1	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
I23O1_HUMAN	P14902	CHEMBL4685	Indoleamine 2,3-dioxygenase	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
MMP12_HUMAN	P39900	CHEMBL4393	Matrix metalloproteinase 12	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
MPIP2_HUMAN	P30305	CHEMBL4804	Dual specificity phosphatase Cdc25B	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMD3A_HUMAN	Q8TCU5	CHEMBL4787	Glutamate [NMDA] receptor subunit 3A	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMD3B_HUMAN	O60391	CHEMBL2913	Glutamate [NMDA] receptor subunit 3B	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMDE1_HUMAN	Q12879	CHEMBL1972	Glutamate [NMDA] receptor subunit epsilon 1	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMDE2_HUMAN	Q13224	CHEMBL1904	Glutamate [NMDA] receptor subunit epsilon 2	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMDE3_HUMAN	Q14957	CHEMBL4109	Glutamate [NMDA] receptor subunit epsilon 3	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMDE4_HUMAN	O15399	CHEMBL2591	Glutamate [NMDA] receptor subunit epsilon 4	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMDZ1_HUMAN	Q05586	CHEMBL2015	Glutamate (NMDA) receptor subunit zeta 1	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
SGMR1_HUMAN	Q99720	CHEMBL287	Sigma opioid receptor	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z104302	Z104302	CHEMBL1907608	Glutamate NMDA receptor	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
AA1R_HUMAN	P30542	CHEMBL226	Adenosine A1 receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
AA2AR_HUMAN	P29274	CHEMBL251	Adenosine A2a receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
AA2AR_RAT	P30543	CHEMBL302	Adenosine A2a receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
AA2BR_RAT	P29276	CHEMBL2592	Adenosine A2b receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ACH10_RAT	Q9JLB5	CHEMBL3461	Neuronal acetylcholine receptor protein alpha-10 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ACHA2_RAT	P12389	CHEMBL2584	Neuronal acetylcholine receptor protein alpha-2 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
ACHA5_RAT	P20420	CHEMBL4960	Neuronal acetylcholine receptor protein alpha-5 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ACHA6_RAT	P43143	CHEMBL4747	Neuronal acetylcholine receptor protein alpha-6 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ACHA7_RAT	Q05941	CHEMBL4980	Neuronal acetylcholine receptor protein alpha-7 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ACHA9_RAT	P43144	CHEMBL2585	Neuronal acetylcholine receptor protein alpha-9 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ACHA_RAT	P25108	CHEMBL3599	Acetylcholine receptor protein alpha chain	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ACHB2_RAT	P12390	CHEMBL3001	Neuronal acetylcholine receptor protein beta-2 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ACHB3_RAT	P12391	CHEMBL4568	Neuronal acetylcholine receptor protein beta-3 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ACHB4_RAT	P12392	CHEMBL2658	Neuronal acetylcholine receptor protein beta-4 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ACHB_RAT	P25109	CHEMBL2666	Acetylcholine receptor protein beta chain	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
AL1A7_RAT	P13601	CHEMBL5354	Aldehyde dehydrogenase, cytosolic 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
AOFA_RAT	P21396	CHEMBL3358	Monoamine oxidase A	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
AOFB_RAT	P19643	CHEMBL2993	Monoamine oxidase B	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
B5SU02_9CNID	B5SU02	CHEMBL1075028	Alpha carbonic anhydrase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
BACE1_HUMAN	P56817	CHEMBL4822	Beta-secretase 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
C0IX24_9CNID	C0IX24	CHEMBL1649055	Carbonic anhydrase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
C11B1_HUMAN	P15538	CHEMBL1908	Cytochrome P450 11B1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
C11B2_HUMAN	P19099	CHEMBL2722	Cytochrome P450 11B2	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH12_HUMAN	O43570	CHEMBL3242	Carbonic anhydrase XII	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH13_MOUSE	Q9D6N1	CHEMBL2186	Carbonic anhydrase XIII	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH14_HUMAN	Q9ULX7	CHEMBL3510	Carbonic anhydrase XIV	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH15_MOUSE	Q99N23	CHEMBL5973	Carbonic anhydrase 15	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH4_BOVIN	Q95323	CHEMBL281	Carbonic anhydrase IV	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH4_HUMAN	P22748	CHEMBL3729	Carbonic anhydrase IV	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH5A_MOUSE	P23589	CHEMBL2330	Carbonic anhydrase VA	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH5B_MOUSE	Q9QZA0	CHEMBL4634	Carbonic anhydrase VB	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH6_HUMAN	P23280	CHEMBL3025	Carbonic anhydrase VI	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH7_HUMAN	P43166	CHEMBL2326	Carbonic anhydrase VII	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH9_HUMAN	Q16790	CHEMBL3594	Carbonic anhydrase IX	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH_METTE	P40881	CHEMBL3932	Carbonic anhydrase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAN_YEAST	P53615	CHEMBL5931	Carbonic anhydrase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CHLE_HUMAN	P06276	CHEMBL1914	Butyrylcholinesterase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CYNT_HELPY	O24855	CHEMBL4211	Carbonic anhydrase 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
DUS3_HUMAN	P51452	CHEMBL2635	Dual specificity protein phosphatase 3	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
EST1_HUMAN	P23141	CHEMBL2265	Acyl coenzyme A:cholesterol acyltransferase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GABT_PIG	P80147	CHEMBL2266	Gamma-amino-N-butyrate transaminase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GRID1_HUMAN	Q9ULK0	CHEMBL2936	Glutamate receptor delta-1 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
HRH3_RAT	Q9QYN8	CHEMBL4124	Histamine H3 receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
HS90A_HUMAN	P07900	CHEMBL3880	Heat shock protein HSP 90-alpha	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
HYES_HUMAN	P34913	CHEMBL2409	Epoxide hydratase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
HYES_MOUSE	P34914	CHEMBL4140	Epoxide hydratase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
I23O1_MOUSE	P28776	CHEMBL1075294	Indoleamine 2,3-dioxygenase 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
LOX5_HUMAN	P09917	CHEMBL215	Arachidonate 5-lipoxygenase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
LOX5_MOUSE	P48999	CHEMBL5211	Arachidonate 5-lipoxygenase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
LOX5_RAT	P12527	CHEMBL312	Arachidonate 5-lipoxygenase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NISCH_HUMAN	Q9Y2I1	CHEMBL3923	Nischarin	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NMDZ1_RAT	P35439	CHEMBL330	Glutamate (NMDA) receptor subunit zeta 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
NQO1_HUMAN	P15559	CHEMBL3623	Quinone reductase 1)	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
OPRD_MOUSE	P32300	CHEMBL3222	Delta opioid receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
OPRK_MOUSE	P33534	CHEMBL4329	Kappa opioid receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
OPRM_MOUSE	P42866	CHEMBL2858	Mu opioid receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
P96878_MYCTU	P96878	CHEMBL5767	PROBABLE TRANSMEMBRANE CARBONIC ANHYDRASE (CARBONATE DEHYDRATASE) (CARBONIC DEHYDRATASE)	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
PGH1_RAT	Q63921	CHEMBL4042	Cyclooxygenase-1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
PGH2_MOUSE	Q05769	CHEMBL4321	Cyclooxygenase-2	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
PGH2_RAT	P35355	CHEMBL2977	Cyclooxygenase-2	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
PHLP2_HUMAN	Q6ZVD8	CHEMBL1275209	PH domain leucine-rich repeat-containing protein phosphatase 2	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Q5AJ71_CANAL	Q5AJ71	CHEMBL5337	Carbonic anhydrase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
SCN1A_RAT	P04774	CHEMBL4906	Sodium channel protein type I alpha subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
SCN2A_RAT	P04775	CHEMBL3399	Sodium channel protein type II alpha subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
SCN3A_RAT	P08104	CHEMBL4966	Sodium channel protein type III alpha subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
SCN8A_RAT	O88420	CHEMBL2752	Sodium channel protein type VIII alpha subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
SGMR1_CAVPO	Q60492	CHEMBL4153	Sigma-1 receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
SGMR1_MOUSE	O55242	CHEMBL3465	Sigma opioid receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
SGMR1_RAT	Q9R0C9	CHEMBL3602	Sigma opioid receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
T23O_MOUSE	P48776	CHEMBL1075307	Tryptophan 2,3-dioxygenase	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Y1284_MYCTU	P64797	CHEMBL5631	Uncharacterized protein Rv1284/MT1322	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z104301	Z104301	CHEMBL1907607	GABA-A receptor; anion channel	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase