BindingDB logo
myBDB logout

BDBM50129212 CHEMBL294742::N-{2-[Benzo[1,3]dioxol-5-ylmethyl-((R)-4-methoxy-benzenesulfonyl)-amino]-2-hydroxycarbamoyl-ethyl}-benzamide

SMILES: COc1ccc(cc1)S(=O)(=O)N(Cc1ccc2OCOc2c1)[C@H](CNC(=O)c1ccccc1)C(=O)NO

InChI Key: InChIKey=RYQBGHHYVCLUFH-OAQYLSRUSA-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 = 50129212   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Bone morphogenetic protein 1


(Homo sapiens (Human))		BDBM50129212
PNG
(CHEMBL294742 | N-{2-[Benzo[1,3]dioxol-5-ylmethyl-(...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N(Cc1ccc2OCOc2c1)[C@H](CNC(=O)c1ccccc1)C(=O)NO
Show InChI InChI=1S/C25H25N3O8S/c1-34-19-8-10-20(11-9-19)37(32,33)28(15-17-7-12-22-23(13-17)36-16-35-22)21(25(30)27-31)14-26-24(29)18-5-3-2-4-6-18/h2-13,21,31H,14-16H2,1H3,(H,26,29)(H,27,30)/t21-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
 14n/an/an/an/an/an/an/an/a



CombiChem Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against procollagen C-terminal proteinase (PCP) in HT-1080 cells using synthetic peptide as substrate

Bioorg Med Chem Lett 13: 2101-4 (2003)


BindingDB Entry DOI: 10.7270/Q2TD9WQS
More data for this
Ligand-Target Pair