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BDBM50253186 CHEMBL4068000

SMILES: [#6]\[#6](-[#6])=[#6]\[#6]-c1cc(cc(-[#8])c1-[#8])-c1coc2c(-[#6]\[#6]=[#6](/[#6])-[#6])c(-[#8])cc(-[#8])c2c1=O

InChI Key: InChIKey=DPLWUTYEBRKBLI-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50253186   
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))		BDBM50253186
PNG
(CHEMBL4068000)
Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-c1cc(cc(-[#8])c1-[#8])-c1coc2c(-[#6]\[#6]=[#6](/[#6])-[#6])c(-[#8])cc(-[#8])c2c1=O
Show InChI InChI=1S/C25H26O6/c1-13(2)5-7-15-9-16(10-21(28)23(15)29)18-12-31-25-17(8-6-14(3)4)19(26)11-20(27)22(25)24(18)30/h5-6,9-12,26-29H,7-8H2,1-4H3
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PC cid
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Similars
Article
PubMed
n/an/a 4.50E+3n/an/an/an/an/an/a



State Key Laboratory of Natural and Biomimetic Drugs, School of Pharmaceutical Sciences, Peking University, 38 Xueyuan Road, Beijing 100191, People's Republic of China.

Curated by ChEMBL


Assay Description
Inhibition of recombinant human PTP1B using p-nitrophenyl phosphate as substrate after 30 mins

Bioorg Med Chem 25: 3706-3713 (2017)


Article DOI: 10.1016/j.bmc.2017.05.009
BindingDB Entry DOI: 10.7270/Q2C82CRZ
More data for this
Ligand-Target Pair