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BDBM50219223 1-(10H-phenothiazin-10-yl)-4-phenylbutan-1-one::CHEMBL394755

SMILES: O=C(CCCc1ccccc1)N1c2ccccc2Sc2ccccc12

InChI Key: InChIKey=IDGMQHJPMVCZGQ-UHFFFAOYSA-N

Data: 2 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50219223   
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
Cholinesterases


(Homo sapiens (Human))
BDBM50219223
PNG
(1-(10H-phenothiazin-10-yl)-4-phenylbutan-1-one | C...)
Show SMILES O=C(CCCc1ccccc1)N1c2ccccc2Sc2ccccc12
Show InChI InChI=1S/C22H19NOS/c24-22(16-8-11-17-9-2-1-3-10-17)23-18-12-4-6-14-20(18)25-21-15-7-5-13-19(21)23/h1-7,9-10,12-15H,8,11,16H2
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

Article
PubMed
220n/an/an/an/an/an/an/an/a



Dalhousie University

Curated by ChEMBL


Assay Description
Inhibition of human plasma BuChE activity


Bioorg Med Chem 15: 6367-78 (2007)


Article DOI: 10.1016/j.bmc.2007.06.060
BindingDB Entry DOI: 10.7270/Q2NC60XP
More data for this
Ligand-Target Pair
Histamine H2 Receptor


(Homo sapiens (Human))
BDBM50219223
PNG
(1-(10H-phenothiazin-10-yl)-4-phenylbutan-1-one | C...)
Show SMILES O=C(CCCc1ccccc1)N1c2ccccc2Sc2ccccc12
Show InChI InChI=1S/C22H19NOS/c24-22(16-8-11-17-9-2-1-3-10-17)23-18-12-4-6-14-20(18)25-21-15-7-5-13-19(21)23/h1-7,9-10,12-15H,8,11,16H2
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
7.50E+3n/an/an/an/an/an/an/an/a



Dalhousie University

Curated by ChEMBL


Assay Description
Antagonist activity at histamine H2 receptor (unknown origin) by PDSP assay


Bioorg Med Chem Lett 23: 3822-5 (2013)


Article DOI: 10.1016/j.bmcl.2013.04.082
BindingDB Entry DOI: 10.7270/Q2H133DC
More data for this
Ligand-Target Pair