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BDBM50292603 2-(pyrrolidin-1-yl)ethyl 10H-phenothiazine-10-carboxylate::CHEMBL481153

SMILES: O=C(OCCN1CCCC1)N1c2ccccc2Sc2ccccc12

InChI Key: InChIKey=CJGNMVAAMQAWEF-UHFFFAOYSA-N

Data: 4 KI

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 4 hits for monomerid = 50292603   
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
Histamine H1 receptor


(Homo sapiens (Human))
BDBM50292603
PNG
(2-(pyrrolidin-1-yl)ethyl 10H-phenothiazine-10-carb...)
Show SMILES O=C(OCCN1CCCC1)N1c2ccccc2Sc2ccccc12
Show InChI InChI=1S/C19H20N2O2S/c22-19(23-14-13-20-11-5-6-12-20)21-15-7-1-3-9-17(15)24-18-10-4-2-8-16(18)21/h1-4,7-10H,5-6,11-14H2
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Article
PubMed
29n/an/an/an/an/an/an/an/a



Dalhousie University

Curated by ChEMBL


Assay Description
Antagonist activity at histamine H1 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
Histamine H2 Receptor


(Homo sapiens (Human))
BDBM50292603
PNG
(2-(pyrrolidin-1-yl)ethyl 10H-phenothiazine-10-carb...)
Show SMILES O=C(OCCN1CCCC1)N1c2ccccc2Sc2ccccc12
Show InChI InChI=1S/C19H20N2O2S/c22-19(23-14-13-20-11-5-6-12-20)21-15-7-1-3-9-17(15)24-18-10-4-2-8-16(18)21/h1-4,7-10H,5-6,11-14H2
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PubMed
540n/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
Cholinesterases


(Homo sapiens (Human))
BDBM50292603
PNG
(2-(pyrrolidin-1-yl)ethyl 10H-phenothiazine-10-carb...)
Show SMILES O=C(OCCN1CCCC1)N1c2ccccc2Sc2ccccc12
Show InChI InChI=1S/C19H20N2O2S/c22-19(23-14-13-20-11-5-6-12-20)21-15-7-1-3-9-17(15)24-18-10-4-2-8-16(18)21/h1-4,7-10H,5-6,11-14H2
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PubMed
650n/an/an/an/an/an/an/an/a



Dalhousie University

Curated by ChEMBL


Assay Description
Inhibition of human serum BchE by Ellman's assay


J Med Chem 51: 4200-12 (2008)


Article DOI: 10.1021/jm8002075
BindingDB Entry DOI: 10.7270/Q24J0DXF
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A


(Homo sapiens (Human))
BDBM50292603
PNG
(2-(pyrrolidin-1-yl)ethyl 10H-phenothiazine-10-carb...)
Show SMILES O=C(OCCN1CCCC1)N1c2ccccc2Sc2ccccc12
Show InChI InChI=1S/C19H20N2O2S/c22-19(23-14-13-20-11-5-6-12-20)21-15-7-1-3-9-17(15)24-18-10-4-2-8-16(18)21/h1-4,7-10H,5-6,11-14H2
PDB

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Article
PubMed
1.90E+3n/an/an/an/an/an/an/an/a



Dalhousie University

Curated by ChEMBL


Assay Description
Antagonist activity at serotonin 5HT3 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