ZINC 12

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  ZINC ID or SMILES

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• Distributions & Clustering
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• Clustered Targets

MicroSource World Drugs

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

Functional 10μM Targets with Highest Number of Available Compounds (109 in total)

Name (Uniprot)	Swissprot	ChEMBL	Description	Size	Browse	Download (Annotations)
Z50425	Z50425	CHEMBL364	Plasmodium falciparum	26	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50597	Z50597	CHEMBL376	Rattus norvegicus	11	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50426	Z50426	CHEMBL612856	Plasmodium falciparum (isolate K1 / Thailand)	6	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z81072	Z81072	CHEMBL397	Jurkat (Acute leukemic T-cells)	6	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80193	Z80193	CHEMBL386	L1210 (Lymphocytic leukemia cells)	5	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80224	Z80224	CHEMBL387	MCF7 (Breast carcinoma cells)	5	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80682	Z80682	CHEMBL392	A549 (Lung carcinoma cells)	5	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50459	Z50459	CHEMBL367	Leishmania donovani	4	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50512	Z50512	CHEMBL369	Cavia porcellus	4	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80156	Z80156	CHEMBL383	HL-60 (Promyeloblast leukemia cells)	4	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80166	Z80166	CHEMBL384	HT-29 (Colon adenocarcinoma cells)	4	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z101870	Z101870	CHEMBL612793	Leishmania guyanensis	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50417	Z50417	CHEMBL612848	Leishmania infantum	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50420	Z50420	CHEMBL612851	Trypanosoma brucei brucei	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50457	Z50457	CHEMBL612877	Leishmania amazonensis	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50458	Z50458	CHEMBL612878	Leishmania braziliensis	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50466	Z50466	CHEMBL368	Trypanosoma cruzi	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50467	Z50467	CHEMBL612884	Trichomonas vaginalis	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80493	Z80493	CHEMBL614925	SK-OV-3 (Ovarian carcinoma cells)	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z81068	Z81068	CHEMBL614649	Ishikawa (Uterine carcinoma cells)	3	Annotations Catalogs	SMILES SDF Mol2 Flexibase
5HT6R_HUMAN	P50406	CHEMBL3371	Serotonin 6 (5-HT6) receptor	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ADRB2_CAVPO	Q8K4Z4	CHEMBL5414	Beta-2 adrenergic receptor	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z100766	Z100766	CHEMBL613712	Radical scavenging activity	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50418	Z50418	CHEMBL612849	Trypanosoma brucei	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50436	Z50436	CHEMBL365	Filobasidiella neoformans	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50442	Z50442	CHEMBL366	Candida albicans	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50607	Z50607	CHEMBL378	Human immunodeficiency virus 1	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50725	Z50725	CHEMBL612348	Trypanosoma brucei rhodesiense	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80064	Z80064	CHEMBL382	CCRF-CEM (T-cell leukemia)	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80255	Z80255	CHEMBL613827	MES-SA/DxS (Uterine sarcoma cells)	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80482	Z80482	CHEMBL614917	SK-MEL-2 (Melanoma cells)	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80600	Z80600	CHEMBL613533	XF498 (Glioma cells)	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80712	Z80712	CHEMBL614361	T47D (Breast carcinoma cells)	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z81024	Z81024	CHEMBL396	NCI-H460 (Non-small cell lung carcinoma)	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z81034	Z81034	CHEMBL614004	A2780 (Ovarian carcinoma cells)	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z81057	Z81057	CHEMBL613979	HUVEC (Umbilical vein endothelial cells)	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z81245	Z81245	CHEMBL614697	MDA-MB-435 (Breast carcinoma cells)	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z81252	Z81252	CHEMBL400	MDA-MB-231 (Breast adenocarcinoma cells)	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z81335	Z81335	CHEMBL612263	HCT-15 (Colon adenocarcinoma cells)	2	Annotations Catalogs	SMILES SDF Mol2 Flexibase
ABL1_HUMAN	P00519	CHEMBL1862	Tyrosine-protein kinase ABL	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
BCR_HUMAN	P11274	CHEMBL5146	Breakpoint cluster region protein	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH2_HUMAN	P00918	CHEMBL205	Carbonic anhydrase II	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
CAH9_HUMAN	Q16790	CHEMBL3594	Carbonic anhydrase IX	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GABR1_HUMAN	Q9UBS5	CHEMBL2064	GABA-B receptor 1	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
GBRB3_HUMAN	P28472	CHEMBL1847	GABA receptor beta-3 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRG2_HUMAN	P18507	CHEMBL1788	GABA receptor gamma-2 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRR1_HUMAN	P24046	CHEMBL3561	GABA receptor rho-1 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRR2_HUMAN	P28476	CHEMBL2375	GABA receptor rho-2 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GBRR3_HUMAN	A8MPY1	CHEMBL2394	GABA receptor rho-3 subunit	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
GPBAR_HUMAN	Q8TDU6	CHEMBL5409	G-protein coupled bile acid receptor 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
HCAR2_HUMAN	Q8TDS4	CHEMBL3785	Nicotinic acid receptor 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
KCNN1_RAT	P70606	CHEMBL3743	Small conductance calcium-activated potassium channel protein 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
KCNN2_RAT	P70604	CHEMBL2547	Small conductance calcium-activated potassium channel protein 2	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
KIT_HUMAN	P10721	CHEMBL1936	Stem cell growth factor receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
PDE5A_RAT	O54735	CHEMBL4567	Phosphodiesterase 5A	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
PGFRA_HUMAN	P16234	CHEMBL2007	Platelet-derived growth factor receptor alpha	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
S6A11_RAT	P31647	CHEMBL3598	GABA transporter 3	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
S6A12_RAT	P48056	CHEMBL5248	Betaine transporter	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
S6A13_RAT	P31646	CHEMBL4889	GABA transporter 2	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
SC6A1_RAT	P23978	CHEMBL4054	GABA transporter 1	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
TRPV1_RAT	O35433	CHEMBL5102	Vanilloid receptor	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
TRPV2_RAT	Q9WUD2	CHEMBL2863	Transient receptor potential cation channel subfamily V member 2	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
TRPV4_RAT	Q9ERZ8	CHEMBL2775	Transient receptor potential cation channel subfamily V member 4	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z101865	Z101865	CHEMBL612790	Leishmania chagasi	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z102013	Z102013	CHEMBL613257	Plasmodium malariae	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z102015	Z102015	CHEMBL613013	Plasmodium vivax	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z102317	Z102317	CHEMBL613617	Brain	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z103192	Z103192	CHEMBL1075362	Trypanosoma evansi	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z103203	Z103203	CHEMBL1075388	A375	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50136	Z50136	CHEMBL612608	Plasmodium falciparum (isolate FcB1 / Columbia)	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50212	Z50212	CHEMBL354	Escherichia coli	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50339	Z50339	CHEMBL613064	Pneumocystis carinii	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50362	Z50362	CHEMBL613075	Lactobacillus casei	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50380	Z50380	CHEMBL613088	Mycobacterium smegmatis	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50416	Z50416	CHEMBL363	Aspergillus fumigatus	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50460	Z50460	CHEMBL612879	Leishmania major	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50461	Z50461	CHEMBL612880	Leishmania mexicana	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50468	Z50468	CHEMBL612652	Giardia intestinalis	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50473	Z50473	CHEMBL612653	Plasmodium berghei	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50530	Z50530	CHEMBL371	Human herpesvirus 5	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50587	Z50587	CHEMBL372	Homo sapiens	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50594	Z50594	CHEMBL375	Mus musculus	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z50643	Z50643	CHEMBL379	Hepatitis C virus	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80036	Z80036	CHEMBL614524	BaF3 (IL-3-dependent pro-B-cells)	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80088	Z80088	CHEMBL613853	CHO (Ovarian cells)	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80119	Z80119	CHEMBL614059	Detroit 98	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80164	Z80164	CHEMBL614580	HT-1080 (Fibrosarcoma cells)	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80171	Z80171	CHEMBL614582	HuTu80	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80178	Z80178	CHEMBL614040	J774.A1 (Macrophage cells)	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80186	Z80186	CHEMBL385	K562 (Erythroleukemia cells)	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80418	Z80418	CHEMBL612557	RAW264.7 (Monocytic-macrophage leukemia cells)	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80457	Z80457	CHEMBL614901	SCC-25	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80459	Z80459	CHEMBL614147	SCC-7	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80583	Z80583	CHEMBL391	Vero (Kidney cells)	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80768	Z80768	CHEMBL614455	CH1 (Ovarian carcinoma cells)	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80830	Z80830	CHEMBL614641	Ehrlich (Ehrlich ascites carcinoma cells)	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80874	Z80874	CHEMBL393	CEM (T-cell leukemia)	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z80928	Z80928	CHEMBL394	HCT-116 (Colon carcinoma cells)	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z81115	Z81115	CHEMBL398	KB (Squamous cell carcinoma)	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z81131	Z81131	CHEMBL612266	L cells (Fibroblasts)	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z81135	Z81135	CHEMBL614793	L6 (Skeletal muscle myoblast cells)	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase
Z81247	Z81247	CHEMBL399	HeLa (Cervical adenocarcinoma cells)	1	Annotations Catalogs	SMILES SDF Mol2 Flexibase