Compile Data Set for Download or QSAR

Found 62 hits of kd for UniProtKB: P11142   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM31995 (ADP | Adenosine Diphosphate (ADP) | CHEMBL14830) Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]1O Show InChI InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a
Vernalis R&D Ltd. Curated by ChEMBL					Assay Description Binding affinity to human Hsc70 by isothermal calorimetry assay				J Med Chem 53: 7280-6 (2010) Article DOI: 10.1021/jm100342z BindingDB Entry DOI: 10.7270/Q25X2956
					More data for this Ligand-Target Pair				3D Structure (docked)
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50085537 (CHEMBL3427682) Show SMILES Nc1ncnc2n([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c(NCc3ccc(Cl)cc3)nc12 |r| Show InChI InChI=1S/C17H19ClN6O4/c18-9-3-1-8(2-4-9)5-20-17-23-11-14(19)21-7-22-15(11)24(17)16-13(27)12(26)10(6-25)28-16/h1-4,7,10,12-13,16,25-27H,5-6H2,(H,20,23)(H2,19,21,22)/t10-,12-,13-,16-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	280	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50085537 (CHEMBL3427682) Show SMILES Nc1ncnc2n([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c(NCc3ccc(Cl)cc3)nc12 |r| Show InChI InChI=1S/C17H19ClN6O4/c18-9-3-1-8(2-4-9)5-20-17-23-11-14(19)21-7-22-15(11)24(17)16-13(27)12(26)10(6-25)28-16/h1-4,7,10,12-13,16,25-27H,5-6H2,(H,20,23)(H2,19,21,22)/t10-,12-,13-,16-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	282	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50085540 (CHEMBL3427679) Show SMILES Cc1ccc(CNc2nc3c(N)ncnc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1 |r| Show InChI InChI=1S/C18H22N6O4/c1-9-2-4-10(5-3-9)6-20-18-23-12-15(19)21-8-22-16(12)24(18)17-14(27)13(26)11(7-25)28-17/h2-5,8,11,13-14,17,25-27H,6-7H2,1H3,(H,20,23)(H2,19,21,22)/t11-,13-,14-,17-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	295	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50085540 (CHEMBL3427679) Show SMILES Cc1ccc(CNc2nc3c(N)ncnc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1 |r| Show InChI InChI=1S/C18H22N6O4/c1-9-2-4-10(5-3-9)6-20-18-23-12-15(19)21-8-22-16(12)24(18)17-14(27)13(26)11(7-25)28-17/h2-5,8,11,13-14,17,25-27H,6-7H2,1H3,(H,20,23)(H2,19,21,22)/t11-,13-,14-,17-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50368125 (ADENOSINE DIPHOSPHATE | ADP) Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO[P@@](O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	n/a	320	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair				3D Structure (crystal)
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50368125 (ADENOSINE DIPHOSPHATE | ADP) Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO[P@@](O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	n/a	324	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair				3D Structure (crystal)
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50443568 (CHEMBL3091929) Show SMILES CCn1c(=O)c(sc1=Cc1cccc[n+]1CCCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)=C1Sc2ccc(cc2N1C)C(C)(F)F |r,w:37.41,8.9| Show InChI InChI=1S/C37H46F2N6O3S3/c1-4-45-31(51-33(34(45)47)35-43(3)27-21-24(37(2,38)39)16-17-28(27)50-35)22-25-13-9-12-20-44(25)19-11-6-5-10-18-40-30(46)15-8-7-14-29-32-26(23-49-29)41-36(48)42-32/h9,12-13,16-17,20-22,26,29,32H,4-8,10-11,14-15,18-19,23H2,1-3H3,(H2-,40,41,42,46,48)/p+1/t26-,29-,32-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a
University of California at San Francisco Curated by ChEMBL					Assay Description Binding affinity to human HSC70 after 3 hrs by ELISA				ACS Med Chem Lett 4: (2013) Article DOI: 10.1021/ml400204n BindingDB Entry DOI: 10.7270/Q2Q81FHC
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50184985 (CHEMBL3822603) Show SMILES Nc1ncnc2n([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c(NCc3ccc(F)cc3)nc12 |r| Show InChI InChI=1S/C17H19FN6O4/c18-9-3-1-8(2-4-9)5-20-17-23-11-14(19)21-7-22-15(11)24(17)16-13(27)12(26)10(6-25)28-16/h1-4,7,10,12-13,16,25-27H,5-6H2,(H,20,23)(H2,19,21,22)/t10-,12-,13-,16-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	457	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50184985 (CHEMBL3822603) Show SMILES Nc1ncnc2n([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c(NCc3ccc(F)cc3)nc12 |r| Show InChI InChI=1S/C17H19FN6O4/c18-9-3-1-8(2-4-9)5-20-17-23-11-14(19)21-7-22-15(11)24(17)16-13(27)12(26)10(6-25)28-16/h1-4,7,10,12-13,16,25-27H,5-6H2,(H,20,23)(H2,19,21,22)/t10-,12-,13-,16-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	460	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50281174 (CHEMBL4168736) Show SMILES [Cl-].CCn1\c(=C\c2scc[n+]2Cc2ccc(o2)C(F)(F)F)s\c(=C2\Sc3cc(Br)ccc3N2C)c1=O Show InChI InChI=1S/C23H18BrF3N3O2S3/c1-3-30-19(11-18-29(8-9-33-18)12-14-5-7-17(32-14)23(25,26)27)35-20(21(30)31)22-28(2)15-6-4-13(24)10-16(15)34-22/h4-11H,3,12H2,1-2H3/q+1/b22-20+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	660	n/a	n/a	n/a	n/a	n/a
University of California at San Francisco Curated by ChEMBL					Assay Description Binding affinity to human HSC70 after 2 hrs by fluorescence shift assay				J Med Chem 61: 6163-6177 (2018) Article DOI: 10.1021/acs.jmedchem.8b00583 BindingDB Entry DOI: 10.7270/Q27P91XM
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM32375 (adenosine-derived inhibitor (Grp78), 9 | adenosine...) Show SMILES Nc1ncnc2n([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c(NCc3ccc4ncccc4c3)nc12 |r| Show InChI InChI=1S/C20H21N7O4/c21-17-14-18(25-9-24-17)27(19-16(30)15(29)13(8-28)31-19)20(26-14)23-7-10-3-4-12-11(6-10)2-1-5-22-12/h1-6,9,13,15-16,19,28-30H,7-8H2,(H,23,26)(H2,21,24,25)/t13-,15-,16-,19-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	n/a	720	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair				3D Structure (crystal)
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM32375 (adenosine-derived inhibitor (Grp78), 9 | adenosine...) Show SMILES Nc1ncnc2n([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c(NCc3ccc4ncccc4c3)nc12 |r| Show InChI InChI=1S/C20H21N7O4/c21-17-14-18(25-9-24-17)27(19-16(30)15(29)13(8-28)31-19)20(26-14)23-7-10-3-4-12-11(6-10)2-1-5-22-12/h1-6,9,13,15-16,19,28-30H,7-8H2,(H,23,26)(H2,21,24,25)/t13-,15-,16-,19-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	n/a	724	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair				3D Structure (crystal)
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50443569 (CHEMBL3091928) Show SMILES CCn1c(=O)c(sc1=Cc1cccc[n+]1CCCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)=C1Sc2ccc(OC)cc2N1C |r,w:37.41,8.9| Show InChI InChI=1S/C36H46N6O4S3/c1-4-42-31(49-33(34(42)44)35-40(2)27-22-25(46-3)16-17-28(27)48-35)21-24-13-9-12-20-41(24)19-11-6-5-10-18-37-30(43)15-8-7-14-29-32-26(23-47-29)38-36(45)39-32/h9,12-13,16-17,20-22,26,29,32H,4-8,10-11,14-15,18-19,23H2,1-3H3,(H2-,37,38,39,43,45)/p+1/t26-,29-,32-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a
University of California at San Francisco Curated by ChEMBL					Assay Description Binding affinity to human HSC70 after 3 hrs by ELISA				ACS Med Chem Lett 4: (2013) Article DOI: 10.1021/ml400204n BindingDB Entry DOI: 10.7270/Q2Q81FHC
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50443566 (CHEMBL3091931) Show SMILES CCn1c(=O)c(sc1=Cc1cccc[n+]1CCCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)=C1Sc2cc(ccc2N1C)C(F)(F)F |r,w:37.41,8.9| Show InChI InChI=1S/C36H43F3N6O3S3/c1-3-45-30(51-32(33(45)47)34-43(2)26-16-15-23(36(37,38)39)20-28(26)50-34)21-24-12-8-11-19-44(24)18-10-5-4-9-17-40-29(46)14-7-6-13-27-31-25(22-49-27)41-35(48)42-31/h8,11-12,15-16,19-21,25,27,31H,3-7,9-10,13-14,17-18,22H2,1-2H3,(H2-,40,41,42,46,48)/p+1/t25-,27-,31-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a
University of California at San Francisco Curated by ChEMBL					Assay Description Binding affinity to human HSC70 after 3 hrs by ELISA				ACS Med Chem Lett 4: (2013) Article DOI: 10.1021/ml400204n BindingDB Entry DOI: 10.7270/Q2Q81FHC
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM32372 (adenosine-derived inhibitor, 6) Show SMILES Nc1ncnc2n([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c(NCc3ccccc3)nc12 |r| Show InChI InChI=1S/C17H20N6O4/c18-14-11-15(21-8-20-14)23(16-13(26)12(25)10(7-24)27-16)17(22-11)19-6-9-4-2-1-3-5-9/h1-5,8,10,12-13,16,24-26H,6-7H2,(H,19,22)(H2,18,20,21)/t10-,12-,13-,16-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM32372 (adenosine-derived inhibitor, 6) Show SMILES Nc1ncnc2n([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c(NCc3ccccc3)nc12 |r| Show InChI InChI=1S/C17H20N6O4/c18-14-11-15(21-8-20-14)23(16-13(26)12(25)10(7-24)27-16)17(22-11)19-6-9-4-2-1-3-5-9/h1-5,8,10,12-13,16,24-26H,6-7H2,(H,19,22)(H2,18,20,21)/t10-,12-,13-,16-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	1.45E+3	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50443575 (CHEMBL3091944) Show SMILES CCn1c(=O)c(sc1=Cc1cccc[n+]1CCCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)=C1Sc2cc(F)ccc2N1C |r,w:37.41,8.9| Show InChI InChI=1S/C35H43FN6O3S3/c1-3-42-30(48-32(33(42)44)34-40(2)26-16-15-23(36)20-28(26)47-34)21-24-12-8-11-19-41(24)18-10-5-4-9-17-37-29(43)14-7-6-13-27-31-25(22-46-27)38-35(45)39-31/h8,11-12,15-16,19-21,25,27,31H,3-7,9-10,13-14,17-18,22H2,1-2H3,(H2-,37,38,39,43,45)/p+1/t25-,27-,31-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a
University of California at San Francisco Curated by ChEMBL					Assay Description Binding affinity to human HSC70 after 3 hrs by ELISA				ACS Med Chem Lett 4: (2013) Article DOI: 10.1021/ml400204n BindingDB Entry DOI: 10.7270/Q2Q81FHC
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50443571 (CHEMBL3091926) Show SMILES CCn1c(=O)c(sc1=Cc1cccc[n+]1CCCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)=C1Sc2cc(Cl)ccc2N1C |r,w:37.41,8.9| Show InChI InChI=1S/C35H43ClN6O3S3/c1-3-42-30(48-32(33(42)44)34-40(2)26-16-15-23(36)20-28(26)47-34)21-24-12-8-11-19-41(24)18-10-5-4-9-17-37-29(43)14-7-6-13-27-31-25(22-46-27)38-35(45)39-31/h8,11-12,15-16,19-21,25,27,31H,3-7,9-10,13-14,17-18,22H2,1-2H3,(H2-,37,38,39,43,45)/p+1/t25-,27-,31-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a	n/a
University of California at San Francisco Curated by ChEMBL					Assay Description Binding affinity to human HSC70 after 3 hrs by ELISA				ACS Med Chem Lett 4: (2013) Article DOI: 10.1021/ml400204n BindingDB Entry DOI: 10.7270/Q2Q81FHC
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50443574 (CHEMBL3091726) Show SMILES CCn1c(=O)c(sc1=Cc1cccc[n+]1CCCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)=C1Sc2c(cccc2F)N1C |r,w:37.41,8.9| Show InChI InChI=1S/C35H43FN6O3S3/c1-3-42-29(47-32(33(42)44)34-40(2)26-15-12-14-24(36)31(26)48-34)21-23-13-8-11-20-41(23)19-10-5-4-9-18-37-28(43)17-7-6-16-27-30-25(22-46-27)38-35(45)39-30/h8,11-15,20-21,25,27,30H,3-7,9-10,16-19,22H2,1-2H3,(H2-,37,38,39,43,45)/p+1/t25-,27-,30-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a
University of California at San Francisco Curated by ChEMBL					Assay Description Binding affinity to human HSC70 after 3 hrs by ELISA				ACS Med Chem Lett 4: (2013) Article DOI: 10.1021/ml400204n BindingDB Entry DOI: 10.7270/Q2Q81FHC
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50443578 (CHEMBL3091941) Show SMILES CCn1c(=Cc2cccc[n+]2CCCCCCNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@H]23)sc(=C2Sc3ccccc3N2C)c1=O |r,w:35.38,4.4| Show InChI InChI=1S/C35H44N6O3S3/c1-3-41-30(47-32(33(41)43)34-39(2)26-15-6-7-16-27(26)46-34)22-24-14-10-13-21-40(24)20-12-5-4-11-19-36-29(42)18-9-8-17-28-31-25(23-45-28)37-35(44)38-31/h6-7,10,13-16,21-22,25,28,31H,3-5,8-9,11-12,17-20,23H2,1-2H3,(H2-,36,37,38,42,44)/p+1/t25-,28-,31-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a
University of California at San Francisco Curated by ChEMBL					Assay Description Binding affinity to human HSC70 after 3 hrs by ELISA				ACS Med Chem Lett 4: (2013) Article DOI: 10.1021/ml400204n BindingDB Entry DOI: 10.7270/Q2Q81FHC
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50443576 (CHEMBL3091943) Show SMILES CCn1c(=O)c(sc1=Cc1cccc[n+]1CCCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)=C1Sc2ccc(F)cc2N1C |r,w:37.41,8.9| Show InChI InChI=1S/C35H43FN6O3S3/c1-3-42-30(48-32(33(42)44)34-40(2)26-20-23(36)15-16-27(26)47-34)21-24-12-8-11-19-41(24)18-10-5-4-9-17-37-29(43)14-7-6-13-28-31-25(22-46-28)38-35(45)39-31/h8,11-12,15-16,19-21,25,28,31H,3-7,9-10,13-14,17-18,22H2,1-2H3,(H2-,37,38,39,43,45)/p+1/t25-,28-,31-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a	n/a
University of California at San Francisco Curated by ChEMBL					Assay Description Binding affinity to human HSC70 after 3 hrs by ELISA				ACS Med Chem Lett 4: (2013) Article DOI: 10.1021/ml400204n BindingDB Entry DOI: 10.7270/Q2Q81FHC
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50281174 (CHEMBL4168736) Show SMILES [Cl-].CCn1\c(=C\c2scc[n+]2Cc2ccc(o2)C(F)(F)F)s\c(=C2\Sc3cc(Br)ccc3N2C)c1=O Show InChI InChI=1S/C23H18BrF3N3O2S3/c1-3-30-19(11-18-29(8-9-33-18)12-14-5-7-17(32-14)23(25,26)27)35-20(21(30)31)22-28(2)15-6-4-13(24)10-16(15)34-22/h4-11H,3,12H2,1-2H3/q+1/b22-20+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.38E+3	n/a	n/a	n/a	n/a	n/a
University of California at San Francisco Curated by ChEMBL					Assay Description Binding affinity to human HSC70 Y149A mutant after 2 hrs by fluorescence shift assay				J Med Chem 61: 6163-6177 (2018) Article DOI: 10.1021/acs.jmedchem.8b00583 BindingDB Entry DOI: 10.7270/Q27P91XM
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50443579 (CHEMBL3091725) Show SMILES CCn1c(=O)c(sc1=Cc1scc[n+]1Cc1ccc(CNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@H]23)cc1)=C1Sc2cccc(F)c2N1C |r,w:38.43,8.9| Show InChI InChI=1S/C35H37FN6O3S4/c1-3-42-29(49-32(33(42)44)34-40(2)31-23(36)7-6-9-26(31)48-34)17-28-41(15-16-46-28)19-22-13-11-21(12-14-22)18-37-27(43)10-5-4-8-25-30-24(20-47-25)38-35(45)39-30/h6-7,9,11-17,24-25,30H,3-5,8,10,18-20H2,1-2H3,(H2-,37,38,39,43,45)/p+1/t24-,25-,30-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a
University of California at San Francisco Curated by ChEMBL					Assay Description Binding affinity to human HSC70 after 3 hrs by ELISA				ACS Med Chem Lett 4: (2013) Article DOI: 10.1021/ml400204n BindingDB Entry DOI: 10.7270/Q2Q81FHC
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50443570 (CHEMBL3091927) Show SMILES CCn1c(=O)c(sc1=Cc1cccc[n+]1CCCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)=C1Sc2c(cccc2Cl)N1C |r,w:37.41,8.9| Show InChI InChI=1S/C35H43ClN6O3S3/c1-3-42-29(47-32(33(42)44)34-40(2)26-15-12-14-24(36)31(26)48-34)21-23-13-8-11-20-41(23)19-10-5-4-9-18-37-28(43)17-7-6-16-27-30-25(22-46-27)38-35(45)39-30/h8,11-15,20-21,25,27,30H,3-7,9-10,16-19,22H2,1-2H3,(H2-,37,38,39,43,45)/p+1/t25-,27-,30-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a	n/a
University of California at San Francisco Curated by ChEMBL					Assay Description Binding affinity to human HSC70 after 3 hrs by ELISA				ACS Med Chem Lett 4: (2013) Article DOI: 10.1021/ml400204n BindingDB Entry DOI: 10.7270/Q2Q81FHC
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50184982 (CHEMBL3822829) Show SMILES Nc1ncnc2n([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c(NCc3ccccc3)c(C#N)c12 |r| Show InChI InChI=1S/C19H20N6O4/c20-6-11-13-16(21)23-9-24-18(13)25(19-15(28)14(27)12(8-26)29-19)17(11)22-7-10-4-2-1-3-5-10/h1-5,9,12,14-15,19,22,26-28H,7-8H2,(H2,21,23,24)/t12-,14-,15-,19-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.75E+3	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50184982 (CHEMBL3822829) Show SMILES Nc1ncnc2n([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c(NCc3ccccc3)c(C#N)c12 |r| Show InChI InChI=1S/C19H20N6O4/c20-6-11-13-16(21)23-9-24-18(13)25(19-15(28)14(27)12(8-26)29-19)17(11)22-7-10-4-2-1-3-5-10/h1-5,9,12,14-15,19,22,26-28H,7-8H2,(H2,21,23,24)/t12-,14-,15-,19-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.80E+3	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50049820 (4-Amino-5-carboxamide-7-(D-ribofuranosyl)pyrrolo[2...) Show SMILES NC(=O)c1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c2ncnc(N)c12 |r| Show InChI InChI=1S/C12H15N5O5/c13-9-6-4(10(14)21)1-17(11(6)16-3-15-9)12-8(20)7(19)5(2-18)22-12/h1,3,5,7-8,12,18-20H,2H2,(H2,14,21)(H2,13,15,16)/t5-,7-,8-,12-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	n/a	3.24E+3	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair				3D Structure (crystal)
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50184984 (CHEMBL3823700) Show SMILES CNc1c(C#N)c2c(N)ncnc2n1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C13H16N6O4/c1-16-11-5(2-14)7-10(15)17-4-18-12(7)19(11)13-9(22)8(21)6(3-20)23-13/h4,6,8-9,13,16,20-22H,3H2,1H3,(H2,15,17,18)/t6-,8-,9-,13-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	3.30E+3	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50049820 (4-Amino-5-carboxamide-7-(D-ribofuranosyl)pyrrolo[2...) Show SMILES NC(=O)c1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c2ncnc(N)c12 |r| Show InChI InChI=1S/C12H15N5O5/c13-9-6-4(10(14)21)1-17(11(6)16-3-15-9)12-8(20)7(19)5(2-18)22-12/h1,3,5,7-8,12,18-20H,2H2,(H2,14,21)(H2,13,15,16)/t5-,7-,8-,12-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	n/a	3.30E+3	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair				3D Structure (crystal)
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50184984 (CHEMBL3823700) Show SMILES CNc1c(C#N)c2c(N)ncnc2n1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C13H16N6O4/c1-16-11-5(2-14)7-10(15)17-4-18-12(7)19(11)13-9(22)8(21)6(3-20)23-13/h4,6,8-9,13,16,20-22H,3H2,1H3,(H2,15,17,18)/t6-,8-,9-,13-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	3.39E+3	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM32373 (adenosine-derived inhibitor (Grp78), 8 | adenosine...) Show SMILES Nc1ncnc2n([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c(NCc3ccc(Cl)c(Cl)c3)nc12 |r| Show InChI InChI=1S/C17H18Cl2N6O4/c18-8-2-1-7(3-9(8)19)4-21-17-24-11-14(20)22-6-23-15(11)25(17)16-13(28)12(27)10(5-26)29-16/h1-3,6,10,12-13,16,26-28H,4-5H2,(H,21,24)(H2,20,22,23)/t10-,12-,13-,16-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	DrugBank MMDB PC cid PC sid PDB UniChem Similars	DrugBank MMDB PDB Article PubMed	n/a	n/a	n/a	3.50E+3	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair				3D Structure (crystal)
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM32373 (adenosine-derived inhibitor (Grp78), 8 | adenosine...) Show SMILES Nc1ncnc2n([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c(NCc3ccc(Cl)c(Cl)c3)nc12 |r| Show InChI InChI=1S/C17H18Cl2N6O4/c18-8-2-1-7(3-9(8)19)4-21-17-24-11-14(20)22-6-23-15(11)25(17)16-13(28)12(27)10(5-26)29-16/h1-3,6,10,12-13,16,26-28H,4-5H2,(H,21,24)(H2,20,22,23)/t10-,12-,13-,16-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	DrugBank MMDB PC cid PC sid PDB UniChem Similars	DrugBank MMDB PDB Article PubMed	n/a	n/a	n/a	3.55E+3	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair				3D Structure (crystal)
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50443572 (CHEMBL3091728) Show SMILES CCn1c(=O)c(sc1=Cc1cccc[n+]1CCCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)=C1Sc2ccc(Cl)cc2N1C |r,w:37.41,8.9| Show InChI InChI=1S/C35H43ClN6O3S3/c1-3-42-30(48-32(33(42)44)34-40(2)26-20-23(36)15-16-27(26)47-34)21-24-12-8-11-19-41(24)18-10-5-4-9-17-37-29(43)14-7-6-13-28-31-25(22-46-28)38-35(45)39-31/h8,11-12,15-16,19-21,25,28,31H,3-7,9-10,13-14,17-18,22H2,1-2H3,(H2-,37,38,39,43,45)/p+1/t25-,28-,31-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a
University of California at San Francisco Curated by ChEMBL					Assay Description Binding affinity to human HSC70 after 3 hrs by ELISA				ACS Med Chem Lett 4: (2013) Article DOI: 10.1021/ml400204n BindingDB Entry DOI: 10.7270/Q2Q81FHC
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50443567 (CHEMBL3091930) Show SMILES CCn1c(=O)c(sc1=Cc1cccc[n+]1CCCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)=C1Sc2cc(OC)ccc2N1C |r,w:37.41,8.9| Show InChI InChI=1S/C36H46N6O4S3/c1-4-42-31(49-33(34(42)44)35-40(2)27-17-16-25(46-3)22-29(27)48-35)21-24-13-9-12-20-41(24)19-11-6-5-10-18-37-30(43)15-8-7-14-28-32-26(23-47-28)38-36(45)39-32/h9,12-13,16-17,20-22,26,28,32H,4-8,10-11,14-15,18-19,23H2,1-3H3,(H2-,37,38,39,43,45)/p+1/t26-,28-,32-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	5.40E+3	n/a	n/a	n/a	n/a	n/a
University of California at San Francisco Curated by ChEMBL					Assay Description Binding affinity to human HSC70 after 3 hrs by ELISA				ACS Med Chem Lett 4: (2013) Article DOI: 10.1021/ml400204n BindingDB Entry DOI: 10.7270/Q2Q81FHC
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50281174 (CHEMBL4168736) Show SMILES [Cl-].CCn1\c(=C\c2scc[n+]2Cc2ccc(o2)C(F)(F)F)s\c(=C2\Sc3cc(Br)ccc3N2C)c1=O Show InChI InChI=1S/C23H18BrF3N3O2S3/c1-3-30-19(11-18-29(8-9-33-18)12-14-5-7-17(32-14)23(25,26)27)35-20(21(30)31)22-28(2)15-6-4-13(24)10-16(15)34-22/h4-11H,3,12H2,1-2H3/q+1/b22-20+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	5.54E+3	n/a	n/a	n/a	n/a	n/a
University of California at San Francisco Curated by ChEMBL					Assay Description Binding affinity to human HSC70 Y149W mutant after 2 hrs by fluorescence shift assay				J Med Chem 61: 6163-6177 (2018) Article DOI: 10.1021/acs.jmedchem.8b00583 BindingDB Entry DOI: 10.7270/Q27P91XM
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM32370 (adenosine-derived inhibitor (Grp78), 2 | adenosine...) Show SMILES Nc1nc2c(N)ncnc2n1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C10H14N6O4/c11-7-4-8(14-2-13-7)16(10(12)15-4)9-6(19)5(18)3(1-17)20-9/h2-3,5-6,9,17-19H,1H2,(H2,12,15)(H2,11,13,14)/t3-,5-,6-,9-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE MMDB PC cid PC sid PDB UniChem Patents Similars	MMDB PDB Article PubMed	n/a	n/a	n/a	6.92E+3	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair				3D Structure (crystal)
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM32370 (adenosine-derived inhibitor (Grp78), 2 | adenosine...) Show SMILES Nc1nc2c(N)ncnc2n1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C10H14N6O4/c11-7-4-8(14-2-13-7)16(10(12)15-4)9-6(19)5(18)3(1-17)20-9/h2-3,5-6,9,17-19H,1H2,(H2,12,15)(H2,11,13,14)/t3-,5-,6-,9-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE MMDB PC cid PC sid PDB UniChem Patents Similars	MMDB PDB Article PubMed	n/a	n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair				3D Structure (crystal)
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50443573 (CHEMBL3091727) Show SMILES CCn1c(=O)c(sc1=Cc1cccc[n+]1CCCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)=C1Sc2cccc(Cl)c2N1C |r,w:37.41,8.9| Show InChI InChI=1S/C35H43ClN6O3S3/c1-3-42-29(48-32(33(42)44)34-40(2)31-24(36)14-12-16-27(31)47-34)21-23-13-8-11-20-41(23)19-10-5-4-9-18-37-28(43)17-7-6-15-26-30-25(22-46-26)38-35(45)39-30/h8,11-14,16,20-21,25-26,30H,3-7,9-10,15,17-19,22H2,1-2H3,(H2-,37,38,39,43,45)/p+1/t25-,26-,30-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	7.70E+3	n/a	n/a	n/a	n/a	n/a
University of California at San Francisco Curated by ChEMBL					Assay Description Binding affinity to human HSC70 after 3 hrs by ELISA				ACS Med Chem Lett 4: (2013) Article DOI: 10.1021/ml400204n BindingDB Entry DOI: 10.7270/Q2Q81FHC
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50281174 (CHEMBL4168736) Show SMILES [Cl-].CCn1\c(=C\c2scc[n+]2Cc2ccc(o2)C(F)(F)F)s\c(=C2\Sc3cc(Br)ccc3N2C)c1=O Show InChI InChI=1S/C23H18BrF3N3O2S3/c1-3-30-19(11-18-29(8-9-33-18)12-14-5-7-17(32-14)23(25,26)27)35-20(21(30)31)22-28(2)15-6-4-13(24)10-16(15)34-22/h4-11H,3,12H2,1-2H3/q+1/b22-20+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	8.25E+3	n/a	n/a	n/a	n/a	n/a
University of California at San Francisco Curated by ChEMBL					Assay Description Binding affinity to human HSC70 T222A mutant after 2 hrs by fluorescence shift assay				J Med Chem 61: 6163-6177 (2018) Article DOI: 10.1021/acs.jmedchem.8b00583 BindingDB Entry DOI: 10.7270/Q27P91XM
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50281175 (CHEMBL4165078) Show SMILES [Cl-].CCn1\c(=C\c2scc[n+]2Cc2ccccc2)s\c(=C2\SCCN2C)c1=O Show InChI InChI=1S/C20H22N3OS3/c1-3-23-17(27-18(19(23)24)20-21(2)9-11-26-20)13-16-22(10-12-25-16)14-15-7-5-4-6-8-15/h4-8,10,12-13H,3,9,11,14H2,1-2H3/q+1/b20-18+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a
University of California at San Francisco Curated by ChEMBL					Assay Description Binding affinity to human HSC70 after 2 hrs by fluorescence shift assay				J Med Chem 61: 6163-6177 (2018) Article DOI: 10.1021/acs.jmedchem.8b00583 BindingDB Entry DOI: 10.7270/Q27P91XM
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50443577 (CHEMBL3091942) Show SMILES CCn1c(=O)c(sc1=Cc1cccc[n+]1CCCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)=C1Sc2cccc(F)c2N1C |r,w:37.41,8.9| Show InChI InChI=1S/C35H43FN6O3S3/c1-3-42-29(48-32(33(42)44)34-40(2)31-24(36)14-12-16-27(31)47-34)21-23-13-8-11-20-41(23)19-10-5-4-9-18-37-28(43)17-7-6-15-26-30-25(22-46-26)38-35(45)39-30/h8,11-14,16,20-21,25-26,30H,3-7,9-10,15,17-19,22H2,1-2H3,(H2-,37,38,39,43,45)/p+1/t25-,26-,30-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.09E+4	n/a	n/a	n/a	n/a	n/a
University of California at San Francisco Curated by ChEMBL					Assay Description Binding affinity to human HSC70 after 3 hrs by ELISA				ACS Med Chem Lett 4: (2013) Article DOI: 10.1021/ml400204n BindingDB Entry DOI: 10.7270/Q2Q81FHC
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50281174 (CHEMBL4168736) Show SMILES [Cl-].CCn1\c(=C\c2scc[n+]2Cc2ccc(o2)C(F)(F)F)s\c(=C2\Sc3cc(Br)ccc3N2C)c1=O Show InChI InChI=1S/C23H18BrF3N3O2S3/c1-3-30-19(11-18-29(8-9-33-18)12-14-5-7-17(32-14)23(25,26)27)35-20(21(30)31)22-28(2)15-6-4-13(24)10-16(15)34-22/h4-11H,3,12H2,1-2H3/q+1/b22-20+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.38E+4	n/a	n/a	n/a	n/a	n/a
University of California at San Francisco Curated by ChEMBL					Assay Description Binding affinity to human HSC70 L228A mutant after 2 hrs by fluorescence shift assay				J Med Chem 61: 6163-6177 (2018) Article DOI: 10.1021/acs.jmedchem.8b00583 BindingDB Entry DOI: 10.7270/Q27P91XM
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM32371 (adenosine-derived inhibitor (Grp78), 3 | adenosine...) Show SMILES CNc1nc2c(N)ncnc2n1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C11H16N6O4/c1-13-11-16-5-8(12)14-3-15-9(5)17(11)10-7(20)6(19)4(2-18)21-10/h3-4,6-7,10,18-20H,2H2,1H3,(H,13,16)(H2,12,14,15)/t4-,6-,7-,10-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	1.70E+4	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM32371 (adenosine-derived inhibitor (Grp78), 3 | adenosine...) Show SMILES CNc1nc2c(N)ncnc2n1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C11H16N6O4/c1-13-11-16-5-8(12)14-3-15-9(5)17(11)10-7(20)6(19)4(2-18)21-10/h3-4,6-7,10,18-20H,2H2,1H3,(H,13,16)(H2,12,14,15)/t4-,6-,7-,10-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	1.70E+4	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50281174 (CHEMBL4168736) Show SMILES [Cl-].CCn1\c(=C\c2scc[n+]2Cc2ccc(o2)C(F)(F)F)s\c(=C2\Sc3cc(Br)ccc3N2C)c1=O Show InChI InChI=1S/C23H18BrF3N3O2S3/c1-3-30-19(11-18-29(8-9-33-18)12-14-5-7-17(32-14)23(25,26)27)35-20(21(30)31)22-28(2)15-6-4-13(24)10-16(15)34-22/h4-11H,3,12H2,1-2H3/q+1/b22-20+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.43E+4	n/a	n/a	n/a	n/a	n/a
University of California at San Francisco Curated by ChEMBL					Assay Description Binding affinity to human HSC70 H227A mutant after 2 hrs by fluorescence shift assay				J Med Chem 61: 6163-6177 (2018) Article DOI: 10.1021/acs.jmedchem.8b00583 BindingDB Entry DOI: 10.7270/Q27P91XM
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50184986 (CHEMBL3823801) Show SMILES CNc1nc2c(N)ncnc2n1[C@@H]1O[C@H](C)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C11H16N6O3/c1-4-6(18)7(19)10(20-4)17-9-5(16-11(17)13-2)8(12)14-3-15-9/h3-4,6-7,10,18-19H,1-2H3,(H,13,16)(H2,12,14,15)/t4-,6-,7-,10-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.70E+4	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50184986 (CHEMBL3823801) Show SMILES CNc1nc2c(N)ncnc2n1[C@@H]1O[C@H](C)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C11H16N6O3/c1-4-6(18)7(19)10(20-4)17-9-5(16-11(17)13-2)8(12)14-3-15-9/h3-4,6-7,10,18-19H,1-2H3,(H,13,16)(H2,12,14,15)/t4-,6-,7-,10-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.75E+4	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50000298 ('2-(4-AMINO-PYRROLO[2,3-D]PYRIMIDIN-7-YL)-5-HYDROX...) Show SMILES Nc1ncnc2n(ccc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C11H14N4O4/c12-9-5-1-2-15(10(5)14-4-13-9)11-8(18)7(17)6(3-16)19-11/h1-2,4,6-8,11,16-18H,3H2,(H2,12,13,14)/t6-,7-,8-,11-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	2.80E+4	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair
Heat shock cognate 71 kDa protein (Homo sapiens (Human))	BDBM50000298 ('2-(4-AMINO-PYRROLO[2,3-D]PYRIMIDIN-7-YL)-5-HYDROX...) Show SMILES Nc1ncnc2n(ccc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C11H14N4O4/c12-9-5-1-2-15(10(5)14-4-13-9)11-8(18)7(17)6(3-16)19-11/h1-2,4,6-8,11,16-18H,3H2,(H2,12,13,14)/t6-,7-,8-,11-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	2.82E+4	n/a	n/a	n/a	n/a	n/a
The Institute of Cancer Research Curated by ChEMBL					Assay Description Binding affinity to human truncated HSC70 NBD (1 to 381 residues) by SPR analysis				J Med Chem 59: 4625-36 (2016) Article DOI: 10.1021/acs.jmedchem.5b02001 BindingDB Entry DOI: 10.7270/Q2Z03B3X
					More data for this Ligand-Target Pair

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