Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Peroxisome proliferator-activated receptor gamma' and Ligand = 'BDBM50471993'   

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
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50471993 (CHEMBL145941) Show SMILES OC(=O)[C@H](Cc1ccc(OCCOc2ccc(SCl)cc2)cc1)Nc1ccccc1C(=O)c1ccccc1 Show InChI InChI=1S/C30H26ClNO5S/c31-38-25-16-14-24(15-17-25)37-19-18-36-23-12-10-21(11-13-23)20-28(30(34)35)32-27-9-5-4-8-26(27)29(33)22-6-2-1-3-7-22/h1-17,28,32H,18-20H2,(H,34,35)/t28-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	199	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Glaxo Wellcome Research and Development Curated by ChEMBL					Assay Description Inhibition by 50% of in vitro binding to Peroxisome proliferator activated receptor gamma				J Med Chem 41: 5037-54 (1998) Article DOI: 10.1021/jm980413z BindingDB Entry DOI: 10.7270/Q2J38W9F
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50471993 (CHEMBL145941) Show SMILES OC(=O)[C@H](Cc1ccc(OCCOc2ccc(SCl)cc2)cc1)Nc1ccccc1C(=O)c1ccccc1 Show InChI InChI=1S/C30H26ClNO5S/c31-38-25-16-14-24(15-17-25)37-19-18-36-23-12-10-21(11-13-23)20-28(30(34)35)32-27-9-5-4-8-26(27)29(33)22-6-2-1-3-7-22/h1-17,28,32H,18-20H2,(H,34,35)/t28-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Glaxo Wellcome Research and Development Curated by ChEMBL					Assay Description Inhibition by 50% of in vitro binding to Peroxisome proliferator activated receptor gamma				J Med Chem 41: 5037-54 (1998) Article DOI: 10.1021/jm980413z BindingDB Entry DOI: 10.7270/Q2J38W9F
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50471993 (CHEMBL145941) Show SMILES OC(=O)[C@H](Cc1ccc(OCCOc2ccc(SCl)cc2)cc1)Nc1ccccc1C(=O)c1ccccc1 Show InChI InChI=1S/C30H26ClNO5S/c31-38-25-16-14-24(15-17-25)37-19-18-36-23-12-10-21(11-13-23)20-28(30(34)35)32-27-9-5-4-8-26(27)29(33)22-6-2-1-3-7-22/h1-17,28,32H,18-20H2,(H,34,35)/t28-/m0/s1	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	n/a	n/a	759	n/a	n/a	n/a	n/a
Glaxo Wellcome Research and Development Curated by ChEMBL					Assay Description Ability to promote differentiation of C3H10T1/2 stem cells to adipocytes using lipogenesis assay mediated through activation of Peroxisome proliferat...				J Med Chem 41: 5037-54 (1998) Article DOI: 10.1021/jm980413z BindingDB Entry DOI: 10.7270/Q2J38W9F
					More data for this Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma (Homo sapiens (Human))	BDBM50471993 (CHEMBL145941) Show SMILES OC(=O)[C@H](Cc1ccc(OCCOc2ccc(SCl)cc2)cc1)Nc1ccccc1C(=O)c1ccccc1 Show InChI InChI=1S/C30H26ClNO5S/c31-38-25-16-14-24(15-17-25)37-19-18-36-23-12-10-21(11-13-23)20-28(30(34)35)32-27-9-5-4-8-26(27)29(33)22-6-2-1-3-7-22/h1-17,28,32H,18-20H2,(H,34,35)/t28-/m0/s1	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	n/a	n/a	191	n/a	n/a	n/a	n/a
Glaxo Wellcome Research and Development Curated by ChEMBL					Assay Description Compound was tested functionally in vitro for inducing 50% of the maximum alkaline phosphate activity (Transactivation) against Peroxisome proliferat...				J Med Chem 41: 5037-54 (1998) Article DOI: 10.1021/jm980413z BindingDB Entry DOI: 10.7270/Q2J38W9F
					More data for this Ligand-Target Pair