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BDBM50100971 CHEMBL40929::N-(3,5-dichlorophenyl)imidodicarbonimidic diamide

SMILES: NC(=N)N=C(N)Nc1cc(Cl)cc(Cl)c1

InChI Key: InChIKey=BUXACHZAYWAZJL-UHFFFAOYSA-N

Data: 2 IC50

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 2 hits for monomerid = 50100971   
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
ITGAV/ITGB3


(Homo sapiens (Human))
BDBM50100971
PNG
(CHEMBL40929 | N-(3,5-dichlorophenyl)imidodicarboni...)
Show SMILES NC(=N)N=C(N)Nc1cc(Cl)cc(Cl)c1 |w:3.2|
Show InChI InChI=1S/C8H9Cl2N5/c9-4-1-5(10)3-6(2-4)14-8(13)15-7(11)12/h1-3H,(H6,11,12,13,14,15)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.35E+4n/an/an/an/an/an/a



Chinese Academy of Medical Sciences and Peking Union Medical College

Curated by ChEMBL


Assay Description
Inhibition of integrin alphavbeta3 mediated cell adhesion of human M21 cells to vitronectiin


Bioorg Med Chem Lett 16: 5878-82 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.061
BindingDB Entry DOI: 10.7270/Q2W66N0W
More data for this
Ligand-Target Pair
ITGAV/ITGB3


(Homo sapiens (Human))
BDBM50100971
PNG
(CHEMBL40929 | N-(3,5-dichlorophenyl)imidodicarboni...)
Show SMILES NC(=N)N=C(N)Nc1cc(Cl)cc(Cl)c1 |w:3.2|
Show InChI InChI=1S/C8H9Cl2N5/c9-4-1-5(10)3-6(2-4)14-8(13)15-7(11)12/h1-3H,(H6,11,12,13,14,15)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 33.5n/an/an/an/an/an/a



Amgen, Inc.

Curated by ChEMBL


Assay Description
Inhibition of integrin alphaVbeta3-mediated adhesion of human cells M21 cells


J Med Chem 53: 4332-53 (2010)


Article DOI: 10.1021/jm9018756
BindingDB Entry DOI: 10.7270/Q21R6QPF
More data for this
Ligand-Target Pair