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BDBM16523 2-(2-chlorophenyl)-6-[(2-chlorophenyl)(3-{[(2,3,4-trimethoxyphenyl)methyl]amino}propyl)amino]-2,3-dihydropyridazin-3-one::2-arylpyridazin-3-one, 29

SMILES: COc1ccc(CNCCCN(c2ccc(=O)n(n2)-c2ccccc2Cl)c2ccccc2Cl)c(OC)c1OC

InChI Key: InChIKey=OLFNUOKBBIASKG-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 16523   
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
MAP Kinase p38 beta


(Mus musculus (mouse))
BDBM16523
PNG
(2-(2-chlorophenyl)-6-[(2-chlorophenyl)(3-{[(2,3,4-...)
Show SMILES COc1ccc(CNCCCN(c2ccc(=O)n(n2)-c2ccccc2Cl)c2ccccc2Cl)c(OC)c1OC
Show InChI InChI=1S/C29H30Cl2N4O4/c1-37-25-14-13-20(28(38-2)29(25)39-3)19-32-17-8-18-34(23-11-6-4-9-21(23)30)26-15-16-27(36)35(33-26)24-12-7-5-10-22(24)31/h4-7,9-16,32H,8,17-19H2,1-3H3
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 600n/an/an/an/an/an/a



Merck Research Laboratories



Assay Description
The biochemical activity of compounds was determined by incubation with p38 enzyme, and substrates in the presence ATP/[gamma-33P] ATP. After the rea...


Bioorg Med Chem Lett 16: 5809-13 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.074
BindingDB Entry DOI: 10.7270/Q28P5XSC
More data for this
Ligand-Target Pair
MAP kinase p38


(Mus musculus (mouse))
BDBM16523
PNG
(2-(2-chlorophenyl)-6-[(2-chlorophenyl)(3-{[(2,3,4-...)
Show SMILES COc1ccc(CNCCCN(c2ccc(=O)n(n2)-c2ccccc2Cl)c2ccccc2Cl)c(OC)c1OC
Show InChI InChI=1S/C29H30Cl2N4O4/c1-37-25-14-13-20(28(38-2)29(25)39-3)19-32-17-8-18-34(23-11-6-4-9-21(23)30)26-15-16-27(36)35(33-26)24-12-7-5-10-22(24)31/h4-7,9-16,32H,8,17-19H2,1-3H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 490n/an/an/an/a7.030



Merck Research Laboratories



Assay Description
The biochemical activity of compounds was determined by incubation with p38 enzyme, and substrates in the presence ATP/[gamma-33P] ATP. After the rea...


Bioorg Med Chem Lett 16: 5809-13 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.074
BindingDB Entry DOI: 10.7270/Q28P5XSC
More data for this
Ligand-Target Pair