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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 = 'BDBM39874'   
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))		BDBM39874
PNG
((4-acetylphenyl) 2,4-dimethoxybenzoate | (4-ethano...)
Show SMILES COc1ccc(C(=O)Oc2ccc(cc2)C(C)=O)c(OC)c1
Show InChI InChI=1S/C17H16O5/c1-11(18)12-4-6-13(7-5-12)22-17(19)15-9-8-14(20-2)10-16(15)21-3/h4-10H,1-3H3
PDB

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PC cid
PC sid
UniChem

Similars
PCBioAssay
n/an/an/an/a 5.14E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
Assay Support: 1 X01 MH077638-01 MLSCN Assay for Allosteric Ligands for the VLA-4 Integrin PI: SKLAR, LARRY A University of New Mexico Assay Overview...

PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2H130FK
More data for this
Ligand-Target Pair