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BDBM50130127 (R)-2-[Benzo[1,3]dioxol-5-ylmethyl-(4-methoxy-benzenesulfonyl)-amino]-5-(4-methanesulfonyl-piperazin-1-yl)-5-oxo-pentanoic acid hydroxyamide::CHEMBL80487

SMILES: COc1ccc(cc1)S(=O)(=O)N(Cc1ccc2OCOc2c1)[C@H](CCC(=O)N1CCN(CC1)S(C)(=O)=O)C(=O)NO

InChI Key: InChIKey=JOWJBDDXZQDSJB-OAQYLSRUSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50130127   
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)
BDBM50130127
PNG
((R)-2-[Benzo[1,3]dioxol-5-ylmethyl-(4-methoxy-benz...)
Show SMILES COc1ccc(cc1)S(=O)(=O)N(Cc1ccc2OCOc2c1)[C@H](CCC(=O)N1CCN(CC1)S(C)(=O)=O)C(=O)NO
Show InChI InChI=1S/C25H32N4O10S2/c1-37-19-4-6-20(7-5-19)41(35,36)29(16-18-3-9-22-23(15-18)39-17-38-22)21(25(31)26-32)8-10-24(30)27-11-13-28(14-12-27)40(2,33)34/h3-7,9,15,21,32H,8,10-14,16-17H2,1-2H3,(H,26,31)/t21-/m1/s1
PDB
MMDB

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Similars

PubMed
340n/an/an/an/an/an/an/an/a



CombiChem Inc.

Curated by ChEMBL


Assay Description
Ability to inhibit procollagen C-terminal proteinase (PCP) tested in vitro


Citation and Details
More data for this
Ligand-Target Pair