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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrin alpha-L/beta-2' and Ligand = 'BDBM50154501'   
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-L/beta-2


(Homo sapiens (Human))		BDBM50154501
PNG
(5-(4-Bromo-benzyl)-7-(3,5-dichloro-phenyl)-5-methy...)
Show SMILES CC1(Cc2ccc(Br)cc2)C(=O)N(c2nncn12)c1cc(Cl)cc(Cl)c1
Show InChI InChI=1S/C18H13BrCl2N4O/c1-18(9-11-2-4-12(19)5-3-11)16(26)25(17-23-22-10-24(17)18)15-7-13(20)6-14(21)8-15/h2-8,10H,9H2,1H3
PDB

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PC cid
PC sid
UniChem

Patents
Article
PubMed
n/an/an/a 40n/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Dissociation constant for human Lymphocyte function associated antigen 1 in LFA-1/ICAM-1 binding assay

J Med Chem 47: 5356-66 (2004)


Article DOI: 10.1021/jm049657b
BindingDB Entry DOI: 10.7270/Q2B857MB
More data for this
Ligand-Target Pair