new BindingDB logo
myBDB logout

BDBM50129214 CHEMBL292706::N-{3-[Benzo[1,3]dioxol-5-ylmethyl-((R)-4-methoxy-benzenesulfonyl)-amino]-3-hydroxycarbamoyl-propyl}-2-pyrrol-1-yl-benzamide

SMILES: COc1ccc(cc1)S(=O)(=O)N(Cc1ccc2OCOc2c1)[C@H](CCNC(=O)c1ccccc1-n1cccc1)C(=O)NO

InChI Key: InChIKey=SFZSTGMKYWNLKB-AREMUKBSSA-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 = 50129214   
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)
BDBM50129214
PNG
(CHEMBL292706 | N-{3-[Benzo[1,3]dioxol-5-ylmethyl-(...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N(Cc1ccc2OCOc2c1)[C@H](CCNC(=O)c1ccccc1-n1cccc1)C(=O)NO
Show InChI InChI=1S/C30H30N4O8S/c1-40-22-9-11-23(12-10-22)43(38,39)34(19-21-8-13-27-28(18-21)42-20-41-27)26(30(36)32-37)14-15-31-29(35)24-6-2-3-7-25(24)33-16-4-5-17-33/h2-13,16-18,26,37H,14-15,19-20H2,1H3,(H,31,35)(H,32,36)/t26-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

PubMed
530n/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


Citation and Details
More data for this
Ligand-Target Pair