BDBM50402227 CHEMBL2204736

SMILES CC(C)CCNC(=O)[C@@H]1CNC[C@H](CN2CC(=O)N(CC2(C)C)c2ccccc2Cl)C1

InChI Key InChIKey=XGYKQWJDBJCEAW-UHFFFAOYSA-N

Data  2 IC50

PDB links: 1 PDB ID matches this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50402227   

TargetRenin(Crab-eating macaque)
Daiichi Sankyo

Curated by ChEMBL
LigandPNGBDBM50402227(CHEMBL2204736)
Affinity DataIC50: 1.00E+3nMAssay Description:Inhibition of renin in cynomolgus monkey plasma after 60 mins by competitive radioimmunoassayMore data for this Ligand-Target Pair
In DepthDetails Article
PubMedPDB3D3D Structure (crystal)
TargetRenin(Human)
Daiichi Sankyo

Curated by ChEMBL
LigandPNGBDBM50402227(CHEMBL2204736)
Affinity DataIC50: 406nMAssay Description:Inhibition of recombinant human renin using Arg-Glu(EDANS)-Ile-His-Pro-Phe-His-Leu-Val-Ile-His-Thr-Lys(DABCYL)-Arg as substrate incubated for 10 mins...More data for this Ligand-Target Pair
In DepthDetails Article
PubMedPDB3D3D Structure (crystal)