BDBM50183633 CHEMBL202963::{(1S)-1-[N'-(biphenyl-4-yl-methyl)-N'-[(2S)-2-hydroxy-2-((1S,2R)-2-hydroxy-indan-1-ylcarbamoyl)-3-phenyl-propyl]-hydrazinocarbonyl]-2,2-dimethyl-propyl}-carbamic acid methyl ester

SMILES: COC(=O)N[C@H](C(=O)NN(Cc1ccc(cc1)-c1ccccc1)C[C@@](O)(Cc1ccccc1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)C(C)(C)C

InChI Key: InChIKey=DYFCEKWVTCPDCS-MCGMGUOFSA-N

Data: 1 KI

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 = 50183633   

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
Human immunodeficiency virus type 1 protease (Human immunodeficiency virus type 1)	BDBM50183633 (CHEMBL202963 | {(1S)-1-[N'-(biphenyl-4-yl-methyl)-...) Show SMILES COC(=O)N[C@H](C(=O)NN(Cc1ccc(cc1)-c1ccccc1)C[C@@](O)(Cc1ccccc1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)C(C)(C)C Show InChI InChI=1S/C40H46N4O6/c1-39(2,3)35(42-38(48)50-4)36(46)43-44(25-28-19-21-30(22-20-28)29-15-9-6-10-16-29)26-40(49,24-27-13-7-5-8-14-27)37(47)41-34-32-18-12-11-17-31(32)23-33(34)45/h5-22,33-35,45,49H,23-26H2,1-4H3,(H,41,47)(H,42,48)(H,43,46)/t33-,34+,35-,40+/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Uppsala University Curated by ChEMBL					Assay Description Inhibition of HIV1 protease				J Med Chem 49: 1828-32 (2006) Article DOI: 10.1021/jm051239z BindingDB Entry DOI: 10.7270/Q2PC3357
					More data for this Ligand-Target Pair