BDBM27044 3-{[(1R,2S,5S)-3-[(2S)-2-cyclohexyl-2-({[(2S)-1-(1,1-dioxo-2,3-dihydro-1,2-benzothiazol-2-yl)-3,3-dimethylbutan-2-yl]carbamoyl}amino)acetyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexan-2-yl]formamido}-2-oxo-N-(prop-2-en-1-yl)hexanamide::bicyclic sultam derivative, 28

SMILES: CCCC(NC(=O)[C@@H]1[C@@H]2[C@H](CN1C(=O)[C@@H](NC(=O)N[C@H](CN1Cc3ccccc3S1(=O)=O)C(C)(C)C)C1CCCCC1)C2(C)C)C(=O)C(=O)NCC=C

InChI Key: InChIKey=WHXFFRGJKOIQCA-CTFQRVNWSA-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 = 27044   

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
Genome polyprotein (Hepatitis C virus (HCV genotype 1a, isolate H))	BDBM27044 (3-{[(1R,2S,5S)-3-[(2S)-2-cyclohexyl-2-({[(2S)-1-(1...) Show SMILES CCCC(NC(=O)[C@@H]1[C@@H]2[C@H](CN1C(=O)[C@@H](NC(=O)N[C@H](CN1Cc3ccccc3S1(=O)=O)C(C)(C)C)C1CCCCC1)C2(C)C)C(=O)C(=O)NCC=C |r| Show InChI InChI=1S/C39H58N6O7S/c1-8-15-27(33(46)35(48)40-20-9-2)41-34(47)32-30-26(39(30,6)7)22-45(32)36(49)31(24-16-11-10-12-17-24)43-37(50)42-29(38(3,4)5)23-44-21-25-18-13-14-19-28(25)53(44,51)52/h9,13-14,18-19,24,26-27,29-32H,2,8,10-12,15-17,20-23H2,1,3-7H3,(H,40,48)(H,41,47)(H2,42,43,50)/t26-,27?,29+,30-,31-,32-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	7	-11.3	n/a	n/a	n/a	n/a	n/a	6.5	30
Schering-Plough Research Institute					Assay Description Proteolytic cleavage of the ester linkage between the Nva (L-norvaline) and the chromophore (PAP) was monitored for change in absorbance at 370 nm. I...				Bioorg Med Chem Lett 19: 1105-9 (2009) Article DOI: 10.1016/j.bmcl.2008.12.111 BindingDB Entry DOI: 10.7270/Q22B8WBZ
					More data for this Ligand-Target Pair