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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein phosphatase non-receptor type 1' and Ligand = 'BDBM50320880'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Tyrosine-protein phosphatase non-receptor type 1


(Homo sapiens (Human))
BDBM50320880
PNG
(7,7-Dimethyl-2-phenyl-4-p-tolyl-4,6,7,8-tetrahydro...)
Show SMILES Cc1ccc(cc1)C1=CC(C2C(=O)CC(C)(C)CC2=N1)c1ccccc1 |c:20,t:8|
Show InChI InChI=1S/C24H25NO/c1-16-9-11-18(12-10-16)20-13-19(17-7-5-4-6-8-17)23-21(25-20)14-24(2,3)15-22(23)26/h4-13,19,23H,14-15H2,1-3H3
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MMDB

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PC cid
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Similars

Article
PubMed
n/an/a 1.96E+4n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of PTP1B assessed as p-nitrophenolate ion production pretreated for 10 mins measured after 30 mins


Bioorg Med Chem 18: 4138-48 (2010)


Article DOI: 10.1016/j.bmc.2009.11.061
BindingDB Entry DOI: 10.7270/Q2DJ5FSF
More data for this
Ligand-Target Pair