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BDBM50216805 (3R)-6-cyclohexyl-3-[3-(1,1-dioxido-2-isothiazolidinyl)-1,2,4-oxadiazol-5-yl]-Nhydroxyhexanamide::CHEMBL227153

SMILES: ONC(=O)C[C@@H](CCCC1CCCCC1)c1nc(CN2CCCS2(=O)=O)no1

InChI Key: InChIKey=JLBFVFOAWVBNFN-OAHLLOKOSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50216805   
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))
BDBM50216805
PNG
((3R)-6-cyclohexyl-3-[3-(1,1-dioxido-2-isothiazolid...)
Show SMILES ONC(=O)C[C@@H](CCCC1CCCCC1)c1nc(CN2CCCS2(=O)=O)no1
Show InChI InChI=1S/C18H30N4O5S/c23-17(20-24)12-15(9-4-8-14-6-2-1-3-7-14)18-19-16(21-27-18)13-22-10-5-11-28(22,25)26/h14-15,24H,1-13H2,(H,20,23)/t15-/m1/s1
PDB
MMDB

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Similars

Article
PubMed
n/an/a 15n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human procollagen C-proteinase expressed in CHO cells


J Med Chem 50: 3442-56 (2007)


Article DOI: 10.1021/jm061010z
BindingDB Entry DOI: 10.7270/Q2W66KGB
More data for this
Ligand-Target Pair