Compile Data Set for Download or QSAR

Found 139 hits with Last Name = 'lack' and Initial = 'na'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Androgen receptor (Homo sapiens (Human))	BDBM50573397 (CHEMBL4856070) Show SMILES Fc1ccc2c(c[nH]c2c1Cl)-c1ccc2ccccc2n1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573398 (CHEMBL4845915) Show SMILES Fc1cc(F)c2[nH]cc(-c3ccc4ccccc4n3)c2c1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573411 (CHEMBL4849023) Show SMILES FC(F)CNC(=O)c1cccc2nc(ccc12)-c1c[nH]c2c(F)c(F)c(F)cc12 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573399 (CHEMBL4870389) Show SMILES Cc1cccc2c(c[nH]c12)-c1ccc2ccccc2n1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573412 (CHEMBL4872533) Show SMILES Fc1cc2c(c[nH]c2c(F)c1F)-c1ccc2c(cccc2n1)C(=O)NC1CC1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573413 (CHEMBL4847082) Show SMILES Fc1cc2c(c[nH]c2c(F)c1F)-c1ccc2c(cccc2n1)-c1cncs1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50425732 (ENZALUTAMIDE | US10053433, FC 4.129 | US10806720, ...) Show SMILES CNC(=O)c1ccc(cc1F)N1C(=S)N(C(=O)C1(C)C)c1ccc(C#N)c(c1)C(F)(F)F Show InChI InChI=1S/C21H16F4N4O2S/c1-20(2)18(31)28(12-5-4-11(10-26)15(8-12)21(23,24)25)19(32)29(20)13-6-7-14(16(22)9-13)17(30)27-3/h4-9H,1-3H3,(H,27,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MCE PC cid PC sid UniChem Similars	DrugBank Article PubMed	n/a	n/a	75	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573390 (CHEMBL4852876) Show SMILES Fc1cc2c(c[nH]c2c(F)c1F)-c1ccc2ccccc2n1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	90	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573396 (CHEMBL4875734) Show SMILES Clc1cccc2c(c[nH]c12)-c1ccc2ccccc2n1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573408 (CHEMBL4857183) Show SMILES Cc1cccc2c(c[nH]c12)-c1ccc2cccc(F)c2n1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573395 (CHEMBL4870138) Show SMILES Fc1cc(Cl)c2[nH]cc(-c3ccc4ccccc4n3)c2c1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573414 (CHEMBL4876258) Show SMILES CNC(=O)c1cccc2nc(ccc12)-c1c[nH]c2c(F)c(F)c(F)cc12 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573394 (CHEMBL4852991) Show SMILES Fc1cc(Cl)cc2c(c[nH]c12)-c1ccc2ccccc2n1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573416 (CHEMBL4866292) Show SMILES CC(C)NC(=O)c1cccc2nc(ccc12)-c1c[nH]c2c(F)c(F)c(F)cc12 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB assessed as reduction in PSA level incubated for 3 days				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573410 (CHEMBL4871740) Show SMILES Cc1cccc2c(c[nH]c12)-c1ccc2cccc(Br)c2n1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573393 (CHEMBL4852542) Show SMILES Cc1c(F)ccc2c(c[nH]c12)-c1ccc2ccccc2n1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573407 (CHEMBL4869391) Show SMILES Cc1cccc2c(c[nH]c12)-c1ccc2cccc(C)c2n1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573415 (CHEMBL4849002) Show SMILES Fc1cc2c(c[nH]c2c(F)c1F)-c1ccc2c(cccc2n1)C(=O)NCC1CC1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573416 (CHEMBL4866292) Show SMILES CC(C)NC(=O)c1cccc2nc(ccc12)-c1c[nH]c2c(F)c(F)c(F)cc12 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573392 (CHEMBL4850974) Show SMILES Fc1ccc2c(c[nH]c2c1F)-c1ccc2ccccc2n1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573409 (CHEMBL4856585) Show SMILES Cc1cccc2c(c[nH]c12)-c1ccc2cccc(Cl)c2n1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573404 (CHEMBL4868944) Show SMILES CNC(=O)c1cccc2nc(ccc12)-c1c[nH]c2c(C)cccc12 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573391 (CHEMBL4877104) Show SMILES Cc1cc(F)cc2c(c[nH]c12)-c1ccc2ccccc2n1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573403 (CHEMBL4868764) Show SMILES Cc1cccc2c(c[nH]c12)-c1ccc2c(cccc2n1)C(F)(F)F Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	240	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573405 (CHEMBL4864867) Show SMILES Cc1cccc2c(c[nH]c12)-c1ccc2ccc(F)cc2n1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50359009 (CHEMBL1924002) Show SMILES NS(=O)(=O)c1ccc2N[C@@H]([C@H]3CC=C[C@H]3c2c1)c1ccc(Br)cc1 |r,c:12| Show InChI InChI=1S/C18H17BrN2O2S/c19-12-6-4-11(5-7-12)18-15-3-1-2-14(15)16-10-13(24(20,22)23)8-9-17(16)21-18/h1-2,4-10,14-15,18,21H,3H2,(H2,20,22,23)/t14-,15+,18-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
University of British Columbia Curated by ChEMBL					Assay Description Transcriptional activity at human androgen receptor BF3 site stably transfected in eGFP-expressing human LNCAP cells after 5 days by fluorometric ana...				J Med Chem 54: 8563-73 (2011) Article DOI: 10.1021/jm201098n BindingDB Entry DOI: 10.7270/Q2QC03X8
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573417 (CHEMBL4875909) Show SMILES Fc1cc2c(c[nH]c2c(F)c1F)-c1ccc2c(cccc2n1)-c1nccs1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573418 (CHEMBL4871449) Show SMILES Fc1cc2c(c[nH]c2c(F)c1F)-c1ccc2c(cccc2n1)C(F)(F)F Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573421 (CHEMBL4848581) Show SMILES [Na;v0+].[Na;v0+].[#6]-[#6](-[#6])-[#7]-[#6](=O)-c1cccc2nc(ccc12)-c1cn(-[#6]-[#8]P([#8-])([#8-])=O)c2c(F)c(F)c(F)cc12 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	660	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573419 (CHEMBL4854145) Show SMILES CC(C)(C)NC(=O)c1cccc2nc(ccc12)-c1c[nH]c2c(F)c(F)c(F)cc12 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	740	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50359008 (CHEMBL1924001) Show SMILES CCOC(=O)c1ccc2N[C@@H]([C@H]3CC=C[C@@H]3c2c1)c1ccccc1 |r,c:13| Show InChI InChI=1S/C21H21NO2/c1-2-24-21(23)15-11-12-19-18(13-15)16-9-6-10-17(16)20(22-19)14-7-4-3-5-8-14/h3-9,11-13,16-17,20,22H,2,10H2,1H3/t16-,17-,20+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
University of British Columbia Curated by ChEMBL					Assay Description Transcriptional activity at human androgen receptor BF3 site stably transfected in eGFP-expressing human LNCAP cells after 5 days by fluorometric ana...				J Med Chem 54: 8563-73 (2011) Article DOI: 10.1021/jm201098n BindingDB Entry DOI: 10.7270/Q2QC03X8
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50359007 (CHEMBL1924000) Show SMILES COC(=O)c1ccc(cc1)[C@H]1Nc2ccc(cc2[C@H]2C=CC[C@@H]12)C(C)=O |r,c:21| Show InChI InChI=1S/C22H21NO3/c1-13(24)16-10-11-20-19(12-16)17-4-3-5-18(17)21(23-20)14-6-8-15(9-7-14)22(25)26-2/h3-4,6-12,17-18,21,23H,5H2,1-2H3/t17-,18+,21+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of British Columbia Curated by ChEMBL					Assay Description Transcriptional activity at human androgen receptor BF3 site stably transfected in eGFP-expressing human LNCAP cells after 5 days by fluorometric ana...				J Med Chem 54: 8563-73 (2011) Article DOI: 10.1021/jm201098n BindingDB Entry DOI: 10.7270/Q2QC03X8
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573389 (CHEMBL4876467) Show SMILES Clc1cc(Cl)c2[nH]cc(-c3ccc4ccccc4n3)c2c1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50425733 (CHEMBL2316547) Show SMILES NS(=O)(=O)c1cccc2cc(SCCOc3ccccc3)[nH]c12 Show InChI InChI=1S/C16H16N2O3S2/c17-23(19,20)14-8-4-5-12-11-15(18-16(12)14)22-10-9-21-13-6-2-1-3-7-13/h1-8,11,18H,9-10H2,(H2,17,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of British Columbia Curated by ChEMBL					Assay Description Inhibition of BF3 site of androgen receptor in human LNCAP cells expressing ARR2PB after 3 days by eGFP transcriptional assay				J Med Chem 56: 1136-48 (2013) Article DOI: 10.1021/jm3015712 BindingDB Entry DOI: 10.7270/Q2ZW1N7N
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573400 (CHEMBL4877237) Show SMILES Cc1cc(C)c2[nH]cc(-c3ccc4ccccc4n3)c2c1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.59E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50425733 (CHEMBL2316547) Show SMILES NS(=O)(=O)c1cccc2cc(SCCOc3ccccc3)[nH]c12 Show InChI InChI=1S/C16H16N2O3S2/c17-23(19,20)14-8-4-5-12-11-15(18-16(12)14)22-10-9-21-13-6-2-1-3-7-13/h1-8,11,18H,9-10H2,(H2,17,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of British Columbia Curated by ChEMBL					Assay Description Inhibition of BF3 site of androgen receptor in human LNCAP cells expressing ARR2PB assessed as reduction in PSA level after 3 days				J Med Chem 56: 1136-48 (2013) Article DOI: 10.1021/jm3015712 BindingDB Entry DOI: 10.7270/Q2ZW1N7N
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573406 (CHEMBL4852702) Show SMILES Cc1cccc2c(c[nH]c12)-c1ccc2ccc(Cl)cc2n1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.65E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50425735 (CHEMBL2316540) Show SMILES Cc1cccc(OCCSc2nc3ccccc3[nH]2)c1 Show InChI InChI=1S/C16H16N2OS/c1-12-5-4-6-13(11-12)19-9-10-20-16-17-14-7-2-3-8-15(14)18-16/h2-8,11H,9-10H2,1H3,(H,17,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of British Columbia Curated by ChEMBL					Assay Description Inhibition of BF3 site of androgen receptor in human LNCAP cells expressing ARR2PB after 3 days by eGFP transcriptional assay				J Med Chem 56: 1136-48 (2013) Article DOI: 10.1021/jm3015712 BindingDB Entry DOI: 10.7270/Q2ZW1N7N
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573401 (CHEMBL4860114) Show SMILES Cc1cc(Cl)c2[nH]cc(-c3ccc4ccccc4n3)c2c1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50425734 (CHEMBL2316542) Show SMILES Cc1cccc(C)c1OCCSc1nc2ccccc2[nH]1 Show InChI InChI=1S/C17H18N2OS/c1-12-6-5-7-13(2)16(12)20-10-11-21-17-18-14-8-3-4-9-15(14)19-17/h3-9H,10-11H2,1-2H3,(H,18,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of British Columbia Curated by ChEMBL					Assay Description Inhibition of BF3 site of androgen receptor in human LNCAP cells expressing ARR2PB assessed as reduction in PSA level after 3 days				J Med Chem 56: 1136-48 (2013) Article DOI: 10.1021/jm3015712 BindingDB Entry DOI: 10.7270/Q2ZW1N7N
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50573402 (CHEMBL4846981) Show SMILES Cc1ccc2c(c[nH]c2c1F)-c1ccc2ccccc2n1 Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.17E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at androgen receptor in human LNCaP cells harboring eGFP/ARRIPB incubated for 3 days by fluorescence method				Citation and Details Article DOI: 10.1021/acs.jmedchem.1c00681 BindingDB Entry DOI: 10.7270/Q2736VQV
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50425734 (CHEMBL2316542) Show SMILES Cc1cccc(C)c1OCCSc1nc2ccccc2[nH]1 Show InChI InChI=1S/C17H18N2OS/c1-12-6-5-7-13(2)16(12)20-10-11-21-17-18-14-8-3-4-9-15(14)19-17/h3-9H,10-11H2,1-2H3,(H,18,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of British Columbia Curated by ChEMBL					Assay Description Inhibition of BF3 site of androgen receptor in human LNCAP cells expressing ARR2PB after 3 days by eGFP transcriptional assay				J Med Chem 56: 1136-48 (2013) Article DOI: 10.1021/jm3015712 BindingDB Entry DOI: 10.7270/Q2ZW1N7N
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50425735 (CHEMBL2316540) Show SMILES Cc1cccc(OCCSc2nc3ccccc3[nH]2)c1 Show InChI InChI=1S/C16H16N2OS/c1-12-5-4-6-13(11-12)19-9-10-20-16-17-14-7-2-3-8-15(14)18-16/h2-8,11H,9-10H2,1H3,(H,17,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of British Columbia Curated by ChEMBL					Assay Description Inhibition of BF3 site of androgen receptor in human LNCAP cells expressing ARR2PB assessed as reduction in PSA level after 3 days				J Med Chem 56: 1136-48 (2013) Article DOI: 10.1021/jm3015712 BindingDB Entry DOI: 10.7270/Q2ZW1N7N
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50425738 (CHEMBL2316544) Show SMILES Clc1ccc(OCCSc2nc3ccccc3[nH]2)cc1 Show InChI InChI=1S/C15H13ClN2OS/c16-11-5-7-12(8-6-11)19-9-10-20-15-17-13-3-1-2-4-14(13)18-15/h1-8H,9-10H2,(H,17,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of British Columbia Curated by ChEMBL					Assay Description Inhibition of BF3 site of androgen receptor in human LNCAP cells expressing ARR2PB after 3 days by eGFP transcriptional assay				J Med Chem 56: 1136-48 (2013) Article DOI: 10.1021/jm3015712 BindingDB Entry DOI: 10.7270/Q2ZW1N7N
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM44830 (2-(2-Phenoxy-ethylsulfanyl)-1H-benzoimidazole | 2-...) Show SMILES C(CSc1nc2ccccc2[nH]1)Oc1ccccc1 Show InChI InChI=1S/C15H14N2OS/c1-2-6-12(7-3-1)18-10-11-19-15-16-13-8-4-5-9-14(13)17-15/h1-9H,10-11H2,(H,16,17)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	4.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of British Columbia Curated by ChEMBL					Assay Description Inhibition of BF3 site of androgen receptor in human LNCAP cells expressing ARR2PB after 3 days by eGFP transcriptional assay				J Med Chem 56: 1136-48 (2013) Article DOI: 10.1021/jm3015712 BindingDB Entry DOI: 10.7270/Q2ZW1N7N
					More data for this Ligand-Target Pair				3D Structure (crystal)
Androgen receptor (Homo sapiens (Human))	BDBM44830 (2-(2-Phenoxy-ethylsulfanyl)-1H-benzoimidazole | 2-...) Show SMILES C(CSc1nc2ccccc2[nH]1)Oc1ccccc1 Show InChI InChI=1S/C15H14N2OS/c1-2-6-12(7-3-1)18-10-11-19-15-16-13-8-4-5-9-14(13)17-15/h1-9H,10-11H2,(H,16,17)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	4.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of British Columbia Curated by ChEMBL					Assay Description Inhibition of BF3 site of androgen receptor in human LNCAP cells expressing ARR2PB assessed as reduction in PSA level after 3 days				J Med Chem 56: 1136-48 (2013) Article DOI: 10.1021/jm3015712 BindingDB Entry DOI: 10.7270/Q2ZW1N7N
					More data for this Ligand-Target Pair				3D Structure (crystal)
Androgen receptor (Homo sapiens (Human))	BDBM50353034 (CHEMBL1302748) Show SMILES COc1cc(ccc1O)C1Nc2cccc3cccc(N1)c23 Show InChI InChI=1S/C18H16N2O2/c1-22-16-10-12(8-9-15(16)21)18-19-13-6-2-4-11-5-3-7-14(20-18)17(11)13/h2-10,18-21H,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of British Columbia Curated by ChEMBL					Assay Description Inhibition of human AR AF2 site expressed in human LNCap cells coexpressing eGFP -ARR2PB assessed as inhibition of transcriptional activity				J Med Chem 54: 6197-205 (2011) Article DOI: 10.1021/jm200532b BindingDB Entry DOI: 10.7270/Q20G3KHB
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50425739 (CHEMBL2316543) Show SMILES Clc1cccc(OCCSc2nc3ccccc3[nH]2)c1 Show InChI InChI=1S/C15H13ClN2OS/c16-11-4-3-5-12(10-11)19-8-9-20-15-17-13-6-1-2-7-14(13)18-15/h1-7,10H,8-9H2,(H,17,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of British Columbia Curated by ChEMBL					Assay Description Inhibition of BF3 site of androgen receptor in human LNCAP cells expressing ARR2PB after 3 days by eGFP transcriptional assay				J Med Chem 56: 1136-48 (2013) Article DOI: 10.1021/jm3015712 BindingDB Entry DOI: 10.7270/Q2ZW1N7N
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50425736 (CHEMBL2316546) Show SMILES C(CSc1cc2ccccc2[nH]1)Oc1ccccc1 Show InChI InChI=1S/C16H15NOS/c1-2-7-14(8-3-1)18-10-11-19-16-12-13-6-4-5-9-15(13)17-16/h1-9,12,17H,10-11H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of British Columbia Curated by ChEMBL					Assay Description Inhibition of BF3 site of androgen receptor in human LNCAP cells expressing ARR2PB after 3 days by eGFP transcriptional assay				J Med Chem 56: 1136-48 (2013) Article DOI: 10.1021/jm3015712 BindingDB Entry DOI: 10.7270/Q2ZW1N7N
					More data for this Ligand-Target Pair
Androgen receptor (Homo sapiens (Human))	BDBM50353033 (CHEMBL1527972) Show SMILES Oc1ccc(cc1)C1Nc2cccc3cccc(N1)c23 Show InChI InChI=1S/C17H14N2O/c20-13-9-7-12(8-10-13)17-18-14-5-1-3-11-4-2-6-15(19-17)16(11)14/h1-10,17-20H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	5.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of British Columbia Curated by ChEMBL					Assay Description Inhibition of human AR AF2 site expressed in human LNCap cells coexpressing eGFP -ARR2PB assessed as inhibition of transcriptional activity				J Med Chem 54: 6197-205 (2011) Article DOI: 10.1021/jm200532b BindingDB Entry DOI: 10.7270/Q20G3KHB
					More data for this Ligand-Target Pair

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