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BDBM50187005 3-(4-nitrophenylamino)-4-(phenylamino)cyclobut-3-ene-1,2-dione::CHEMBL209782

SMILES: [O-][N+](=O)c1ccc(Nc2c(Nc3ccccc3)c(=O)c2=O)cc1

InChI Key: InChIKey=KMDVWWHAJHLVKP-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50187005   
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
C-X-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50187005
PNG
(3-(4-nitrophenylamino)-4-(phenylamino)cyclobut-3-e...)
Show SMILES [O-][N+](=O)c1ccc(Nc2c(Nc3ccccc3)c(=O)c2=O)cc1
Show InChI InChI=1S/C16H11N3O4/c20-15-13(17-10-4-2-1-3-5-10)14(16(15)21)18-11-6-8-12(9-7-11)19(22)23/h1-9,17-18H
PDB

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Article
PubMed
n/an/a 8.60E+3n/an/an/an/an/an/a



Pharmacopeia Drug Discovery, Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]IL8 from human CXCR2 expressed in CHO cells


Bioorg Med Chem Lett 16: 4107-10 (2006)


Article DOI: 10.1016/j.bmcl.2006.04.082
BindingDB Entry DOI: 10.7270/Q24X57DB
More data for this
Ligand-Target Pair