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BDBM50129205 2-[Benzo[1,3]dioxol-5-ylmethyl-((R)-4-methoxy-benzenesulfonyl)-amino]-4-(3-1H-benzoimidazol-2-yl-propionylamino)-N-hydroxy-butyramide::CHEMBL292336

SMILES: COc1ccc(cc1)S(=O)(=O)N(Cc1ccc2OCOc2c1)[C@H](CCNC(=O)CCc1nc2ccccc2[nH]1)C(=O)NO

InChI Key: InChIKey=LGQDWTDDKYTDOP-XMMPIXPASA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50129205   
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))
BDBM50129205
PNG
(2-[Benzo[1,3]dioxol-5-ylmethyl-((R)-4-methoxy-benz...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N(Cc1ccc2OCOc2c1)[C@H](CCNC(=O)CCc1nc2ccccc2[nH]1)C(=O)NO
Show InChI InChI=1S/C29H31N5O8S/c1-40-20-7-9-21(10-8-20)43(38,39)34(17-19-6-11-25-26(16-19)42-18-41-25)24(29(36)33-37)14-15-30-28(35)13-12-27-31-22-4-2-3-5-23(22)32-27/h2-11,16,24,37H,12-15,17-18H2,1H3,(H,30,35)(H,31,32)(H,33,36)/t24-/m1/s1
PDB
MMDB

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PC cid
PC sid
UniChem
PubMed
410n/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