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BDBM50075756 4-(3-(4-fluorophenyl)-5-(4-(methylsulfinyl)phenyl)-1H-pyrrol-2-yl)pyridine::4-[3-(4-Fluoro-phenyl)-5-(4-methanesulfinyl-phenyl)-1H-pyrrol-2-yl]-pyridine::CHEMBL155687::CHEMBL2435136

SMILES: CS(=O)c1ccc(cc1)-c1cc(c([nH]1)-c1ccncc1)-c1ccc(F)cc1

InChI Key: InChIKey=MHSKRZAFVKHGJT-UHFFFAOYSA-N

Data: 4 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50075756   
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
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50075756
PNG
(4-(3-(4-fluorophenyl)-5-(4-(methylsulfinyl)phenyl)...)
Show SMILES CS(=O)c1ccc(cc1)-c1cc(c([nH]1)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C22H17FN2OS/c1-27(26)19-8-4-16(5-9-19)21-14-20(15-2-6-18(23)7-3-15)22(25-21)17-10-12-24-13-11-17/h2-14,25H,1H3
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt
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PC sid
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PubMed
n/an/a 670n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against p38-alpha kinase


Bioorg Med Chem Lett 9: 641-6 (1999)


BindingDB Entry DOI: 10.7270/Q2VD6XM1
More data for this
Ligand-Target Pair
Glucagon receptor


(Homo sapiens (Human))
BDBM50075756
PNG
(4-(3-(4-fluorophenyl)-5-(4-(methylsulfinyl)phenyl)...)
Show SMILES CS(=O)c1ccc(cc1)-c1cc(c([nH]1)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C22H17FN2OS/c1-27(26)19-8-4-16(5-9-19)21-14-20(15-2-6-18(23)7-3-15)22(25-21)17-10-12-24-13-11-17/h2-14,25H,1H3
PDB
MMDB

UniProtKB/SwissProt

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

Patents


Similars

Article
n/an/a 671n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human glucagon receptor


Citation and Details

Article DOI: 10.1007/s00044-013-0801-3
BindingDB Entry DOI: 10.7270/Q20G3MM3
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50075756
PNG
(4-(3-(4-fluorophenyl)-5-(4-(methylsulfinyl)phenyl)...)
Show SMILES CS(=O)c1ccc(cc1)-c1cc(c([nH]1)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C22H17FN2OS/c1-27(26)19-8-4-16(5-9-19)21-14-20(15-2-6-18(23)7-3-15)22(25-21)17-10-12-24-13-11-17/h2-14,25H,1H3
PDB
MMDB

NCI pathway
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KEGG

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PC sid
UniChem

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Article
PubMed
n/an/a 670n/an/an/an/an/an/a



Islamic University of Gaza

Curated by ChEMBL


Assay Description
Inhibition of p38alpha MAP kinase (unknown origin)


J Med Chem 52: 2613-7 (2009)


Article DOI: 10.1021/jm801467h
BindingDB Entry DOI: 10.7270/Q21Z449S
More data for this
Ligand-Target Pair
Glucagon receptor


(Homo sapiens (Human))
BDBM50075756
PNG
(4-(3-(4-fluorophenyl)-5-(4-(methylsulfinyl)phenyl)...)
Show SMILES CS(=O)c1ccc(cc1)-c1cc(c([nH]1)-c1ccncc1)-c1ccc(F)cc1
Show InChI InChI=1S/C22H17FN2OS/c1-27(26)19-8-4-16(5-9-19)21-14-20(15-2-6-18(23)7-3-15)22(25-21)17-10-12-24-13-11-17/h2-14,25H,1H3
PDB
MMDB

UniProtKB/SwissProt

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

Patents


Similars

PubMed
n/an/a 1.10E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity determined by reduction in binding of 125 I-glucagon to the human glucagon receptor expressed on CHO cells in absence of Mg+2


Bioorg Med Chem Lett 9: 641-6 (1999)


BindingDB Entry DOI: 10.7270/Q2VD6XM1
More data for this
Ligand-Target Pair