BDBM254035 US9493430, 575

SMILES: COc1cc(F)c(cc1C1=C(CN2[C@@H](C)[C@H](OC2=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F)CC(C)(C)CC1)-c1ccc(cc1)C(O)=O

InChI Key: InChIKey=AZJLDTWYYQRRTE-PBYQXAPXSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 254035   

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
Cholesteryl ester transfer protein (Homo sapiens (Human))	BDBM254035 (US9493430, 575) Show SMILES COc1cc(F)c(cc1C1=C(CN2[C@@H](C)[C@H](OC2=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F)CC(C)(C)CC1)-c1ccc(cc1)C(O)=O |r,c:10| Show InChI InChI=1S/C35H32F7NO5/c1-18-30(21-11-23(34(37,38)39)13-24(12-21)35(40,41)42)48-32(46)43(18)17-22-16-33(2,3)10-9-25(22)27-14-26(28(36)15-29(27)47-4)19-5-7-20(8-6-19)31(44)45/h5-8,11-15,18,30H,9-10,16-17H2,1-4H3,(H,44,45)/t18-,30-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	14.6	n/a	n/a	n/a	n/a	n/a	n/a
Chong Kun Dang Pharmaceutical Corp. US Patent					Assay Description As a protein source for cholesteryl ester transfer, plasma from healthy persons was used, and as a cholesteryl ester receptor, LDL from healthy perso...				US Patent US9493430 (2016) BindingDB Entry DOI: 10.7270/Q2W37V7V
					More data for this Ligand-Target Pair