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BDBM50223366 1-((4-phenyl-1H-imidazol-2-yl)methyl)-3-(4-phenylthiazol-2-yl)urea::CHEMBL393210

SMILES: O=C(NCc1nc(c[nH]1)-c1ccccc1)Nc1nc(cs1)-c1ccccc1

InChI Key: InChIKey=VVVIVRROAZHDAR-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 = 50223366   
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
Enoyl-ACP Reductase (FabK)


(Streptococcus pneumoniae)
BDBM50223366
PNG
(1-((4-phenyl-1H-imidazol-2-yl)methyl)-3-(4-phenylt...)
Show SMILES O=C(NCc1nc(c[nH]1)-c1ccccc1)Nc1nc(cs1)-c1ccccc1
Show InChI InChI=1S/C20H17N5OS/c26-19(25-20-24-17(13-27-20)15-9-5-2-6-10-15)22-12-18-21-11-16(23-18)14-7-3-1-4-8-14/h1-11,13H,12H2,(H,21,23)(H2,22,24,25,26)
PDB
MMDB

KEGG

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>3.20E+4n/an/an/an/an/an/a



Meiji Seika Kaisha, Ltd

Curated by ChEMBL


Assay Description
Inhibition of Streptococcus pneumoniae enoyl-ACP reductase FabK


Bioorg Med Chem 15: 7325-36 (2007)


Article DOI: 10.1016/j.bmc.2007.08.050
BindingDB Entry DOI: 10.7270/Q25T3MBH
More data for this
Ligand-Target Pair
Enoyl-ACP Reductase (FabI)


(Escherichia coli)
BDBM50223366
PNG
(1-((4-phenyl-1H-imidazol-2-yl)methyl)-3-(4-phenylt...)
Show SMILES O=C(NCc1nc(c[nH]1)-c1ccccc1)Nc1nc(cs1)-c1ccccc1
Show InChI InChI=1S/C20H17N5OS/c26-19(25-20-24-17(13-27-20)15-9-5-2-6-10-15)22-12-18-21-11-16(23-18)14-7-3-1-4-8-14/h1-11,13H,12H2,(H,21,23)(H2,22,24,25,26)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>3.20E+4n/an/an/an/an/an/a



Meiji Seika Kaisha, Ltd

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli enoyl-ACP reductase FabI


Bioorg Med Chem 15: 7325-36 (2007)


Article DOI: 10.1016/j.bmc.2007.08.050
BindingDB Entry DOI: 10.7270/Q25T3MBH
More data for this
Ligand-Target Pair