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SMILES: Cc1cc(I)cc2C3C=CCC3C(Nc12)c1cccc(N)c1

InChI Key: InChIKey=INBIXBPYYMPJEB-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50201806   
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))		BDBM50201806
PNG
(CHEMBL3905288)
Show SMILES Cc1cc(I)cc2C3C=CCC3C(Nc12)c1cccc(N)c1 |c:8|
Show InChI InChI=1S/C19H19IN2/c1-11-8-13(20)10-17-15-6-3-7-16(15)19(22-18(11)17)12-4-2-5-14(21)9-12/h2-6,8-10,15-16,19,22H,7,21H2,1H3
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PC cid
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Article
PubMed
n/an/a 7.50E+3n/an/an/an/an/an/a



Xi'an Jiaotong University

Curated by ChEMBL


Assay Description
Inhibition of PTP1B (unknown origin)

Eur J Med Chem 122: 756-769 (2016)


Article DOI: 10.1016/j.ejmech.2016.05.060
BindingDB Entry DOI: 10.7270/Q25Q4Z2D
More data for this
Ligand-Target Pair