Compile Data Set for Download or QSAR

Found 86 hits with Last Name = 'liu' and Initial = 'qf'   

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
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50197093 (CHEMBL3959018) Show SMILES Clc1ccc2nc(N3CCCCC3)c(-c3nnn[nH]3)c(-c3ccccc3)c2c1 Show InChI InChI=1S/C21H19ClN6/c22-15-9-10-17-16(13-15)18(14-7-3-1-4-8-14)19(20-24-26-27-25-20)21(23-17)28-11-5-2-6-12-28/h1,3-4,7-10,13H,2,5-6,11-12H2,(H,24,25,26,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	87	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair				3D Structure (crystal)
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468379 (CHEMBL4295114) Show SMILES COc1ccc(c2ccccc12)S(=O)(=O)Nc1cc(ccc1F)C(O)=O Show InChI InChI=1S/C18H14FNO5S/c1-25-16-8-9-17(13-5-3-2-4-12(13)16)26(23,24)20-15-10-11(18(21)22)6-7-14(15)19/h2-10,20H,1H3,(H,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair				3D Structure (crystal)
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468371 (CHEMBL4283424) Show SMILES COc1ccc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(c1)C(O)=O Show InChI InChI=1S/C18H14FNO5S/c1-25-16-8-9-17(13-5-3-2-4-12(13)16)26(23,24)20-11-6-7-15(19)14(10-11)18(21)22/h2-10,20H,1H3,(H,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	210	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair				3D Structure (crystal)
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468377 (CHEMBL4280127) Show SMILES COc1ccc(c2ccccc12)S(=O)(=O)Nc1cc(C(O)=O)c(F)cc1F Show InChI InChI=1S/C18H13F2NO5S/c1-26-16-6-7-17(11-5-3-2-4-10(11)16)27(24,25)21-15-8-12(18(22)23)13(19)9-14(15)20/h2-9,21H,1H3,(H,22,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	230	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468360 (CHEMBL4280900) Show SMILES CCc1c(c(nn1-c1ccccc1-c1ccccc1OCC(O)=O)-c1ccccc1)-c1ccccc1 Show InChI InChI=1S/C31H26N2O3/c1-2-26-30(22-13-5-3-6-14-22)31(23-15-7-4-8-16-23)32-33(26)27-19-11-9-17-24(27)25-18-10-12-20-28(25)36-21-29(34)35/h3-20H,2,21H2,1H3,(H,34,35)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	350	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468359 (CHEMBL4285684) Show SMILES COc1ccc(c2ccccc12)S(=O)(=O)Nc1cccc(c1)C(O)=O Show InChI InChI=1S/C18H15NO5S/c1-24-16-9-10-17(15-8-3-2-7-14(15)16)25(22,23)19-13-6-4-5-12(11-13)18(20)21/h2-11,19H,1H3,(H,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	400	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468369 (CHEMBL4282996) Show SMILES COc1ccc(c2ccccc12)S(=O)(=O)Nc1cccc(CCC(O)=O)c1 Show InChI InChI=1S/C20H19NO5S/c1-26-18-10-11-19(17-8-3-2-7-16(17)18)27(24,25)21-15-6-4-5-14(13-15)9-12-20(22)23/h2-8,10-11,13,21H,9,12H2,1H3,(H,22,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	580	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468366 (CHEMBL4292481) Show SMILES COc1ccc(c2ccccc12)S(=O)(=O)NCCCCC(O)=O Show InChI InChI=1S/C16H19NO5S/c1-22-14-9-10-15(13-7-3-2-6-12(13)14)23(20,21)17-11-5-4-8-16(18)19/h2-3,6-7,9-10,17H,4-5,8,11H2,1H3,(H,18,19)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	590	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair				3D Structure (crystal)
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468385 (CHEMBL4278392) Show SMILES COc1ccc(c2ccccc12)S(=O)(=O)NCc1ccc(cc1)C(O)=O Show InChI InChI=1S/C19H17NO5S/c1-25-17-10-11-18(16-5-3-2-4-15(16)17)26(23,24)20-12-13-6-8-14(9-7-13)19(21)22/h2-11,20H,12H2,1H3,(H,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	760	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468386 (CHEMBL4284461) Show SMILES COc1ccc(c2ccccc12)S(=O)(=O)Nc1cc(Cl)cc(c1)C(O)=O Show InChI InChI=1S/C18H14ClNO5S/c1-25-16-6-7-17(15-5-3-2-4-14(15)16)26(23,24)20-13-9-11(18(21)22)8-12(19)10-13/h2-10,20H,1H3,(H,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	820	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468382 (CHEMBL4293529) Show SMILES COc1ccc(c2ccccc12)S(=O)(=O)Nc1cccc(CC(O)=O)c1 Show InChI InChI=1S/C19H17NO5S/c1-25-17-9-10-18(16-8-3-2-7-15(16)17)26(23,24)20-14-6-4-5-13(11-14)12-19(21)22/h2-11,20H,12H2,1H3,(H,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	840	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468358 (CHEMBL4280730) Show SMILES Cc1c(C)c(C)c(c(C)c1C)S(=O)(=O)NCCCCC(O)=O Show InChI InChI=1S/C16H25NO4S/c1-10-11(2)13(4)16(14(5)12(10)3)22(20,21)17-9-7-6-8-15(18)19/h17H,6-9H2,1-5H3,(H,18,19)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	910	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468374 (CHEMBL4279007) Show SMILES COc1ccc(c2ccccc12)S(=O)(=O)Nc1cc(ccc1Cl)C(O)=O Show InChI InChI=1S/C18H14ClNO5S/c1-25-16-8-9-17(13-5-3-2-4-12(13)16)26(23,24)20-15-10-11(18(21)22)6-7-14(15)19/h2-10,20H,1H3,(H,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	930	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468373 (CHEMBL4286775) Show SMILES COc1ccc(c2ccccc12)S(=O)(=O)Nc1cc(F)cc(c1)C(O)=O Show InChI InChI=1S/C18H14FNO5S/c1-25-16-6-7-17(15-5-3-2-4-14(15)16)26(23,24)20-13-9-11(18(21)22)8-12(19)10-13/h2-10,20H,1H3,(H,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.15E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468365 (CHEMBL4285291) Show SMILES OC(=O)CCCCNS(=O)(=O)c1ccc(Br)c2ccccc12 Show InChI InChI=1S/C15H16BrNO4S/c16-13-8-9-14(12-6-2-1-5-11(12)13)22(20,21)17-10-4-3-7-15(18)19/h1-2,5-6,8-9,17H,3-4,7,10H2,(H,18,19)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	1.16E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair				3D Structure (crystal)
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468362 (CHEMBL4289194) Show SMILES OC(=O)CCCCNS(=O)(=O)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C11H13Cl2NO4S/c12-8-5-9(13)7-10(6-8)19(17,18)14-4-2-1-3-11(15)16/h5-7,14H,1-4H2,(H,15,16)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.19E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468389 (CHEMBL4281855) Show SMILES COc1ccc(c2ccccc12)S(=O)(=O)Nc1ccc(cc1)C(O)=O Show InChI InChI=1S/C18H15NO5S/c1-24-16-10-11-17(15-5-3-2-4-14(15)16)25(22,23)19-13-8-6-12(7-9-13)18(20)21/h2-11,19H,1H3,(H,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	1.28E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50319701 (2-(2-(3,5-dichlorophenylamino)-2-oxoethylthio)acet...) Show SMILES OC(=O)CSCC(=O)Nc1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C10H9Cl2NO3S/c11-6-1-7(12)3-8(2-6)13-9(14)4-17-5-10(15)16/h1-3H,4-5H2,(H,13,14)(H,15,16)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.66E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468367 (CHEMBL4289068) Show SMILES COc1ccc(c2ccccc12)S(=O)(=O)Nc1ccc(CC(O)=O)cc1 Show InChI InChI=1S/C19H17NO5S/c1-25-17-10-11-18(16-5-3-2-4-15(16)17)26(23,24)20-14-8-6-13(7-9-14)12-19(21)22/h2-11,20H,12H2,1H3,(H,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	1.67E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468388 (CHEMBL4277336) Show SMILES OC(=O)CCCCNS(=O)(=O)c1ccc(Cl)c2ccccc12 Show InChI InChI=1S/C15H16ClNO4S/c16-13-8-9-14(12-6-2-1-5-11(12)13)22(20,21)17-10-4-3-7-15(18)19/h1-2,5-6,8-9,17H,3-4,7,10H2,(H,18,19)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.85E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468381 (CHEMBL4286617) Show SMILES Cc1cc(C)c(C)c(c1C)S(=O)(=O)NCCCCC(O)=O Show InChI InChI=1S/C15H23NO4S/c1-10-9-11(2)13(4)15(12(10)3)21(19,20)16-8-6-5-7-14(17)18/h9,16H,5-8H2,1-4H3,(H,17,18)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.95E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468368 (CHEMBL4279523) Show SMILES COc1ccc(c2ccccc12)S(=O)(=O)NCc1cccc(c1)C(O)=O Show InChI InChI=1S/C19H17NO5S/c1-25-17-9-10-18(16-8-3-2-7-15(16)17)26(23,24)20-12-13-5-4-6-14(11-13)19(21)22/h2-11,20H,12H2,1H3,(H,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.12E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468364 (CHEMBL4288633) Show SMILES OC(=O)CCCCNS(=O)(=O)c1ccc(F)c2ccccc12 Show InChI InChI=1S/C15H16FNO4S/c16-13-8-9-14(12-6-2-1-5-11(12)13)22(20,21)17-10-4-3-7-15(18)19/h1-2,5-6,8-9,17H,3-4,7,10H2,(H,18,19)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.16E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468361 (CHEMBL4292619) Show SMILES OC(=O)CCCNS(=O)(=O)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C10H11Cl2NO4S/c11-7-4-8(12)6-9(5-7)18(16,17)13-3-1-2-10(14)15/h4-6,13H,1-3H2,(H,14,15)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	2.55E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468380 (CHEMBL4294524) Show SMILES Cc1cc(C)c(c(C)c1)S(=O)(=O)NCCCCC(O)=O Show InChI InChI=1S/C14H21NO4S/c1-10-8-11(2)14(12(3)9-10)20(18,19)15-7-5-4-6-13(16)17/h8-9,15H,4-7H2,1-3H3,(H,16,17)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.69E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468375 (CHEMBL4286939) Show SMILES COc1ccc(c2ccccc12)S(=O)(=O)Nc1cc(ccc1C)C(O)=O Show InChI InChI=1S/C19H17NO5S/c1-12-7-8-13(19(21)22)11-16(12)20-26(23,24)18-10-9-17(25-2)14-5-3-4-6-15(14)18/h3-11,20H,1-2H3,(H,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.76E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468384 (CHEMBL4288136) Show SMILES OC(=O)CCCNC(=O)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C11H11Cl2NO3/c12-8-4-7(5-9(13)6-8)11(17)14-3-1-2-10(15)16/h4-6H,1-3H2,(H,14,17)(H,15,16)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	4.32E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468363 (CHEMBL4281331) Show SMILES OC(=O)CCCCCNS(=O)(=O)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C12H15Cl2NO4S/c13-9-6-10(14)8-11(7-9)20(18,19)15-5-3-1-2-4-12(16)17/h6-8,15H,1-5H2,(H,16,17)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	4.84E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468391 (CHEMBL4291264) Show SMILES COc1ccc(c2ccccc12)S(=O)(=O)Nc1cccc(C(O)=O)c1C Show InChI InChI=1S/C19H17NO5S/c1-12-13(19(21)22)8-5-9-16(12)20-26(23,24)18-11-10-17(25-2)14-6-3-4-7-15(14)18/h3-11,20H,1-2H3,(H,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>6.14E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468383 (CHEMBL4282481) Show SMILES COc1ccc(cc1NS(=O)(=O)c1ccc(OC)c2ccccc12)C(O)=O Show InChI InChI=1S/C19H17NO6S/c1-25-16-9-10-18(14-6-4-3-5-13(14)16)27(23,24)20-15-11-12(19(21)22)7-8-17(15)26-2/h3-11,20H,1-2H3,(H,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>6.14E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468372 (CHEMBL4294676) Show SMILES COc1ccc(c2ccccc12)S(=O)(=O)Nc1ccc(C)c(c1)C(O)=O Show InChI InChI=1S/C19H17NO5S/c1-12-7-8-13(11-16(12)19(21)22)20-26(23,24)18-10-9-17(25-2)14-5-3-4-6-15(14)18/h3-11,20H,1-2H3,(H,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>6.14E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468376 (CHEMBL4290351) Show SMILES COc1ccc(c2ccccc12)S(=O)(=O)Nc1cc(ccn1)C(O)=O Show InChI InChI=1S/C17H14N2O5S/c1-24-14-6-7-15(13-5-3-2-4-12(13)14)25(22,23)19-16-10-11(17(20)21)8-9-18-16/h2-10H,1H3,(H,18,19)(H,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>6.14E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468392 (CHEMBL4290764) Show SMILES COc1ccc(c2ccccc12)S(=O)(=O)Nc1cncc(c1)C(O)=O Show InChI InChI=1S/C17H14N2O5S/c1-24-15-6-7-16(14-5-3-2-4-13(14)15)25(22,23)19-12-8-11(17(20)21)9-18-10-12/h2-10,19H,1H3,(H,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>6.14E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468390 (CHEMBL4290187) Show SMILES COc1ccc(c2ccccc12)S(=O)(=O)NC(C)c1cccc(c1)C(O)=O Show InChI InChI=1S/C20H19NO5S/c1-13(14-6-5-7-15(12-14)20(22)23)21-27(24,25)19-11-10-18(26-2)16-8-3-4-9-17(16)19/h3-13,21H,1-2H3,(H,22,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>6.14E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468387 (CHEMBL4284742) Show SMILES OC(=O)CCNS(=O)(=O)c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C9H9Cl2NO4S/c10-6-3-7(11)5-8(4-6)17(15,16)12-2-1-9(13)14/h3-5,12H,1-2H2,(H,13,14)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	6.51E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468378 (CHEMBL4294166) Show SMILES COc1ccc(c2ccccc12)S(=O)(=O)Nc1ccc(F)c(C(O)=O)c1F Show InChI InChI=1S/C18H13F2NO5S/c1-26-14-8-9-15(11-5-3-2-4-10(11)14)27(24,25)21-13-7-6-12(19)16(17(13)20)18(22)23/h2-9,21H,1H3,(H,22,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	7.38E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50468370 (CHEMBL4293576) Show SMILES COc1ccc(c2ccccc12)S(=O)(=O)Nc1cccc(C(O)=O)c1F Show InChI InChI=1S/C18H14FNO5S/c1-25-15-9-10-16(12-6-3-2-5-11(12)15)26(23,24)20-14-8-4-7-13(17(14)19)18(21)22/h2-10,20H,1H3,(H,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	7.75E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair				3D Structure (crystal)
Fibroblast growth factor receptor 1 (Homo sapiens (Human))	BDBM50263183 ((+)-haematoxylin | (+)-hematoxylin | (6aS,11bR)-7,...) Show SMILES Oc1ccc2[C@H]3c4cc(O)c(O)cc4C[C@@]3(O)COc2c1O |r| Show InChI InChI=1S/C16H14O6/c17-10-2-1-8-13-9-4-12(19)11(18)3-7(9)5-16(13,21)6-22-15(8)14(10)20/h1-4,13,17-21H,5-6H2/t13-,16+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	320	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Materia Medica Curated by ChEMBL					Assay Description Inhibition of FGFR1 (unknown origin) by ELISA				J Med Chem 51: 4419-29 (2008) Article DOI: 10.1021/jm701501x BindingDB Entry DOI: 10.7270/Q2N879MQ
					More data for this Ligand-Target Pair
Hepatocyte growth factor receptor (Homo sapiens (Human))	BDBM50263015 (CHEMBL478611 | epihematoxylol) Show SMILES O[C@@H]1c2ccc(O)c(O)c2OC[C@]1(O)Cc1ccc(O)c(O)c1 |r| Show InChI InChI=1S/C16H16O7/c17-10-3-1-8(5-12(10)19)6-16(22)7-23-14-9(15(16)21)2-4-11(18)13(14)20/h1-5,15,17-22H,6-7H2/t15-,16-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Materia Medica Curated by ChEMBL					Assay Description Inhibition of c-Met (unknown origin) by ELISA				J Med Chem 51: 4419-29 (2008) Article DOI: 10.1021/jm701501x BindingDB Entry DOI: 10.7270/Q2N879MQ
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50263015 (CHEMBL478611 | epihematoxylol) Show SMILES O[C@@H]1c2ccc(O)c(O)c2OC[C@]1(O)Cc1ccc(O)c(O)c1 |r| Show InChI InChI=1S/C16H16O7/c17-10-3-1-8(5-12(10)19)6-16(22)7-23-14-9(15(16)21)2-4-11(18)13(14)20/h1-5,15,17-22H,6-7H2/t15-,16-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Materia Medica Curated by ChEMBL					Assay Description Inhibition of c-Src (unknown origin) by ELISA				J Med Chem 51: 4419-29 (2008) Article DOI: 10.1021/jm701501x BindingDB Entry DOI: 10.7270/Q2N879MQ
					More data for this Ligand-Target Pair
Hepatocyte growth factor receptor (Homo sapiens (Human))	BDBM50263183 ((+)-haematoxylin | (+)-hematoxylin | (6aS,11bR)-7,...) Show SMILES Oc1ccc2[C@H]3c4cc(O)c(O)cc4C[C@@]3(O)COc2c1O |r| Show InChI InChI=1S/C16H14O6/c17-10-2-1-8-13-9-4-12(19)11(18)3-7(9)5-16(13,21)6-22-15(8)14(10)20/h1-4,13,17-21H,5-6H2/t13-,16+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Materia Medica Curated by ChEMBL					Assay Description Inhibition of c-Met (unknown origin) by ELISA				J Med Chem 51: 4419-29 (2008) Article DOI: 10.1021/jm701501x BindingDB Entry DOI: 10.7270/Q2N879MQ
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50263183 ((+)-haematoxylin | (+)-hematoxylin | (6aS,11bR)-7,...) Show SMILES Oc1ccc2[C@H]3c4cc(O)c(O)cc4C[C@@]3(O)COc2c1O |r| Show InChI InChI=1S/C16H14O6/c17-10-2-1-8-13-9-4-12(19)11(18)3-7(9)5-16(13,21)6-22-15(8)14(10)20/h1-4,13,17-21H,5-6H2/t13-,16+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	440	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Materia Medica Curated by ChEMBL					Assay Description Inhibition of c-Src (unknown origin) by ELISA				J Med Chem 51: 4419-29 (2008) Article DOI: 10.1021/jm701501x BindingDB Entry DOI: 10.7270/Q2N879MQ
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 1 (Homo sapiens (Human))	BDBM50263015 (CHEMBL478611 | epihematoxylol) Show SMILES O[C@@H]1c2ccc(O)c(O)c2OC[C@]1(O)Cc1ccc(O)c(O)c1 |r| Show InChI InChI=1S/C16H16O7/c17-10-3-1-8(5-12(10)19)6-16(22)7-23-14-9(15(16)21)2-4-11(18)13(14)20/h1-5,15,17-22H,6-7H2/t15-,16-/m1/s1	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	560	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Materia Medica Curated by ChEMBL					Assay Description Inhibition of FGFR1 (unknown origin) by ELISA				J Med Chem 51: 4419-29 (2008) Article DOI: 10.1021/jm701501x BindingDB Entry DOI: 10.7270/Q2N879MQ
					More data for this Ligand-Target Pair
Fibroblast growth factor receptor 1 (Homo sapiens (Human))	BDBM50263016 (CHEMBL477560 | hematoxylene) Show SMILES Oc1ccc(CC2=Cc3ccc(O)c(O)c3OC2)cc1O |t:6| Show InChI InChI=1S/C16H14O5/c17-12-3-1-9(7-14(12)19)5-10-6-11-2-4-13(18)15(20)16(11)21-8-10/h1-4,6-7,17-20H,5,8H2	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	600	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Materia Medica Curated by ChEMBL					Assay Description Inhibition of FGFR1 (unknown origin) by ELISA				J Med Chem 51: 4419-29 (2008) Article DOI: 10.1021/jm701501x BindingDB Entry DOI: 10.7270/Q2N879MQ
					More data for this Ligand-Target Pair
Mast/stem cell growth factor receptor Kit (Homo sapiens (Human))	BDBM50263015 (CHEMBL478611 | epihematoxylol) Show SMILES O[C@@H]1c2ccc(O)c(O)c2OC[C@]1(O)Cc1ccc(O)c(O)c1 |r| Show InChI InChI=1S/C16H16O7/c17-10-3-1-8(5-12(10)19)6-16(22)7-23-14-9(15(16)21)2-4-11(18)13(14)20/h1-5,15,17-22H,6-7H2/t15-,16-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Materia Medica Curated by ChEMBL					Assay Description Inhibition of cKit (unknown origin) by ELISA				J Med Chem 51: 4419-29 (2008) Article DOI: 10.1021/jm701501x BindingDB Entry DOI: 10.7270/Q2N879MQ
					More data for this Ligand-Target Pair
Fatty acid-binding protein, adipocyte (Homo sapiens (Human))	BDBM50197093 (CHEMBL3959018) Show SMILES Clc1ccc2nc(N3CCCCC3)c(-c3nnn[nH]3)c(-c3ccccc3)c2c1 Show InChI InChI=1S/C21H19ClN6/c22-15-9-10-17-16(13-15)18(14-7-3-1-4-8-14)19(20-24-26-27-25-20)21(23-17)28-11-5-2-6-12-28/h1,3-4,7-10,13H,2,5-6,11-12H2,(H,24,25,26,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	710	n/a	n/a	n/a	n/a	n/a	n/a
Fudan University Curated by ChEMBL					Assay Description Displacement of 1,8-ANS from FABP4 (unknown origin) after 3 mins by fluorescence assay				Eur J Med Chem 154: 44-59 (2018) Article DOI: 10.1016/j.ejmech.2018.05.007 BindingDB Entry DOI: 10.7270/Q2BR8VWB
					More data for this Ligand-Target Pair				3D Structure (crystal)
Hepatocyte growth factor receptor (Homo sapiens (Human))	BDBM50263016 (CHEMBL477560 | hematoxylene) Show SMILES Oc1ccc(CC2=Cc3ccc(O)c(O)c3OC2)cc1O |t:6| Show InChI InChI=1S/C16H14O5/c17-12-3-1-9(7-14(12)19)5-10-6-11-2-4-13(18)15(20)16(11)21-8-10/h1-4,6-7,17-20H,5,8H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	760	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Materia Medica Curated by ChEMBL					Assay Description Inhibition of c-Met (unknown origin) by ELISA				J Med Chem 51: 4419-29 (2008) Article DOI: 10.1021/jm701501x BindingDB Entry DOI: 10.7270/Q2N879MQ
					More data for this Ligand-Target Pair
Hepatocyte growth factor receptor (Homo sapiens (Human))	BDBM50263017 (CHEMBL477768 | hematoxylone) Show SMILES Oc1ccc(C[C@@]2(O)COc3c(O)c(O)ccc3C2=O)cc1O |r| Show InChI InChI=1S/C16H14O7/c17-10-3-1-8(5-12(10)19)6-16(22)7-23-14-9(15(16)21)2-4-11(18)13(14)20/h1-5,17-20,22H,6-7H2/t16-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	850	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Materia Medica Curated by ChEMBL					Assay Description Inhibition of c-Met (unknown origin) by ELISA				J Med Chem 51: 4419-29 (2008) Article DOI: 10.1021/jm701501x BindingDB Entry DOI: 10.7270/Q2N879MQ
					More data for this Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2 (Homo sapiens (Human))	BDBM50263183 ((+)-haematoxylin | (+)-hematoxylin | (6aS,11bR)-7,...) Show SMILES Oc1ccc2[C@H]3c4cc(O)c(O)cc4C[C@@]3(O)COc2c1O |r| Show InChI InChI=1S/C16H14O6/c17-10-2-1-8-13-9-4-12(19)11(18)3-7(9)5-16(13,21)6-22-15(8)14(10)20/h1-4,13,17-21H,5-6H2/t13-,16+/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	960	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Materia Medica Curated by ChEMBL					Assay Description Inhibition of ErbB2 (unknown origin) by ELISA				J Med Chem 51: 4419-29 (2008) Article DOI: 10.1021/jm701501x BindingDB Entry DOI: 10.7270/Q2N879MQ
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50190664 (CHEMBL3974642) Show SMILES [H][C@@]12CC=C3[C@]([H])(CC[C@@H](C)[C@]3(C)[C@]1([H])C2(C)C)[C@H](CC(C)C)c1c(O)c(C=O)c(O)c(C=O)c1O |r,t:3| Show InChI InChI=1S/C28H38O5/c1-14(2)11-17(22-24(32)18(12-29)23(31)19(13-30)25(22)33)16-8-7-15(3)28(6)20(16)9-10-21-26(28)27(21,4)5/h9,12-17,21,26,31-33H,7-8,10-11H2,1-6H3/t15-,16-,17+,21-,26+,28+/m1/s1	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	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of PTP1B (unknown origin) using pNPP as substrate after 3 mins by colorimetric analysis				J Nat Prod 79: 1365-72 (2016) Article DOI: 10.1021/acs.jnatprod.6b00090 BindingDB Entry DOI: 10.7270/Q27W6F46
					More data for this Ligand-Target Pair

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