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BDBM50295553 4-(4-(4-fluorophenyl)-1-(3-phenylpropyl)-5-(pyridin-4-yl)-1H-imidazol-2-yl)but-3-yn-1-ol::4-[4-(4-Fluoro-phenyl)-1-(3-phenyl-propyl)-5-pyridin-4-yl-1H-imidazol-2-yl]-but-3-yn-1-ol::CHEMBL190333::RWJ-67657

SMILES: OCCC#Cc1nc(c(-c2ccncc2)n1CCCc1ccccc1)-c1ccc(F)cc1

InChI Key: InChIKey=QSUSKMBNZQHHPA-UHFFFAOYSA-N

Data: 2 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50295553   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Mitogen-activated protein kinase 1


(Toxoplasma gondii)
BDBM50295553
PNG
(4-(4-(4-fluorophenyl)-1-(3-phenylpropyl)-5-(pyridi...)
Show SMILES OCCC#Cc1nc(c(-c2ccncc2)n1CCCc1ccccc1)-c1ccc(F)cc1
Show InChI InChI=1S/C27H24FN3O/c28-24-13-11-22(12-14-24)26-27(23-15-17-29-18-16-23)31(25(30-26)10-4-5-20-32)19-6-9-21-7-2-1-3-8-21/h1-3,7-8,11-18,32H,5-6,9,19-20H2
UniProtKB/TrEMBL

GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 200n/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii recombinant MAPK1 expressed in Escherichia coli


Antimicrob Agents Chemother 51: 4324-8 (2007)


Article DOI: 10.1128/AAC.00680-07
BindingDB Entry DOI: 10.7270/Q2Q52QJG
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase 14


(Homo sapiens (Human))
BDBM50295553
PNG
(4-(4-(4-fluorophenyl)-1-(3-phenylpropyl)-5-(pyridi...)
Show SMILES OCCC#Cc1nc(c(-c2ccncc2)n1CCCc1ccccc1)-c1ccc(F)cc1
Show InChI InChI=1S/C27H24FN3O/c28-24-13-11-22(12-14-24)26-27(23-15-17-29-18-16-23)31(25(30-26)10-4-5-20-32)19-6-9-21-7-2-1-3-8-21/h1-3,7-8,11-18,32H,5-6,9,19-20H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 1.00E+3n/an/an/an/an/an/a



Tulane University School of Medicine

Curated by ChEMBL


Assay Description
Inhibition of human recombinant p38alpha assessed as [gamma33P]ATP utilization by microplate scintillation counting


Antimicrob Agents Chemother 51: 4324-8 (2007)


Article DOI: 10.1128/AAC.00680-07
BindingDB Entry DOI: 10.7270/Q2Q52QJG
More data for this
Ligand-Target Pair