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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrin alpha-4' and Ligand = 'BDBM75435'   
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
Integrin alpha-4


(Homo sapiens (Human))		BDBM75435
PNG
((4-methoxyphenyl)-(2-morpholin-4-yl-5-nitro-phenyl...)
Show SMILES COc1ccc(cc1)C(=O)c1cc(ccc1N1CCOCC1)[N+]([O-])=O
Show InChI InChI=1S/C18H18N2O5/c1-24-15-5-2-13(3-6-15)18(21)16-12-14(20(22)23)4-7-17(16)19-8-10-25-11-9-19/h2-7,12H,8-11H2,1H3
PDB

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PC cid
PC sid
UniChem

Similars
PCBioAssay
n/an/an/an/a>3.00E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support Project Title:HTS for Identification of VLA-4 Allosteric Modulators 1 R01 HL081062-01 PI:Lar...

PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2ZG6QP2
More data for this
Ligand-Target Pair