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BDBM50130116 (R)-2-[Benzo[1,3]dioxol-5-ylmethyl-(4-methoxy-benzenesulfonyl)-amino]-pentanedioic acid 5-dimethylamide 1-hydroxyamide::CHEMBL76980

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

InChI Key: InChIKey=KBNSLHCEOXXBKJ-GOSISDBHSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50130116   
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))
BDBM50130116
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)N(C)C)C(=O)NO
Show InChI InChI=1S/C22H27N3O8S/c1-24(2)21(26)11-9-18(22(27)23-28)25(13-15-4-10-19-20(12-15)33-14-32-19)34(29,30)17-7-5-16(31-3)6-8-17/h4-8,10,12,18,28H,9,11,13-14H2,1-3H3,(H,23,27)/t18-/m1/s1
PDB
MMDB

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PC cid
PC sid
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PubMed
330n/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


Bioorg Med Chem Lett 13: 2381-4 (2003)


BindingDB Entry DOI: 10.7270/Q26H4GS8
More data for this
Ligand-Target Pair