null

SMILES: CCC(C)c1cccc2c(C(O)=O)c(O)c(nc12)-c1ccc(Cl)cc1

InChI Key: InChIKey=RURLXZQEUHZJRR-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50201916   

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
P-selectin glycoprotein ligand 1 (Homo sapiens (Human))	BDBM50201916 (8-sec-butyl-2-(4-chlorophenyl)-3-hydroxyquinoline-...) Show SMILES CCC(C)c1cccc2c(C(O)=O)c(O)c(nc12)-c1ccc(Cl)cc1 Show InChI InChI=1S/C20H18ClNO3/c1-3-11(2)14-5-4-6-15-16(20(24)25)19(23)17(22-18(14)15)12-7-9-13(21)10-8-12/h4-11,23H,3H2,1-2H3,(H,24,25)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of P-selectin-mediated adhesion of HL60 cells				J Med Chem 50: 21-39 (2007) Article DOI: 10.1021/jm0602256 BindingDB Entry DOI: 10.7270/Q2Z60PVV
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM50201916 (8-sec-butyl-2-(4-chlorophenyl)-3-hydroxyquinoline-...) Show SMILES CCC(C)c1cccc2c(C(O)=O)c(O)c(nc12)-c1ccc(Cl)cc1 Show InChI InChI=1S/C20H18ClNO3/c1-3-11(2)14-5-4-6-15-16(20(24)25)19(23)17(22-18(14)15)12-7-9-13(21)10-8-12/h4-11,23H,3H2,1-2H3,(H,24,25)	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	3.01E+5	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of human recombinant DHOD expressed in Escherichia coli				J Med Chem 50: 21-39 (2007) Article DOI: 10.1021/jm0602256 BindingDB Entry DOI: 10.7270/Q2Z60PVV
					More data for this Ligand-Target Pair