BindingDB logo
myBDB logout

null

SMILES: CS(=O)(=O)c1ccc(C(=O)NC(Cc2ccc3nc(ccc3c2)-c2c(Cl)cccc2Cl)C(O)=O)c(Cl)c1

InChI Key: InChIKey=GWXWMVWWYIESGE-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 17217   
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
Integrin alpha-4/beta-1 [T112H]


(Homo sapiens (Human))		BDBM17217
PNG
(2,6-quinolinyl derivative, 39 | 2-[(2-chloro-4-met...)
Show SMILES CS(=O)(=O)c1ccc(C(=O)NC(Cc2ccc3nc(ccc3c2)-c2c(Cl)cccc2Cl)C(O)=O)c(Cl)c1
Show InChI InChI=1S/C26H19Cl3N2O5S/c1-37(35,36)16-7-8-17(20(29)13-16)25(32)31-23(26(33)34)12-14-5-9-21-15(11-14)6-10-22(30-21)24-18(27)3-2-4-19(24)28/h2-11,13,23H,12H2,1H3,(H,31,32)(H,33,34)
PDB

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 3.5n/an/an/an/a7.422



UCB



Assay Description
The VLA-4 expressing U937 cells were plated in 96-well microtiter plates, precoated with soluble human recombinant VCAM-1, in the presence of test co...

Bioorg Med Chem Lett 17: 142-6 (2007)


Article DOI: 10.1016/j.bmcl.2006.09.069
BindingDB Entry DOI: 10.7270/Q2W957FD
More data for this
Ligand-Target Pair