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SMILES: CC1(C)CC(=O)C2C(C=C(N=C2C1)c1ccccc1)c1ccc(cc1)[N+]([O-])=O

InChI Key: InChIKey=KWXLHRWYRPHVGL-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50320875   
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
Tyrosine-protein phosphatase non-receptor type 1


(Homo sapiens (Human))		BDBM50320875
PNG
(7,7-Dimethyl-4-(4-nitrophenyl)-2-phenyl-4,6,7,8-te...)
Show SMILES CC1(C)CC(=O)C2C(C=C(N=C2C1)c1ccccc1)c1ccc(cc1)[N+]([O-])=O |c:8,10|
Show InChI InChI=1S/C23H22N2O3/c1-23(2)13-20-22(21(26)14-23)18(15-8-10-17(11-9-15)25(27)28)12-19(24-20)16-6-4-3-5-7-16/h3-12,18,22H,13-14H2,1-2H3
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MMDB

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Similars
Article
PubMed
n/an/a 6.10E+3n/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