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SMILES: C1CN(CCN1)c1nc2ccccc2c-2c1COc1ccccc-21

InChI Key: InChIKey=UUHGENRJAPGWMG-UHFFFAOYSA-N

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 = 50031937   
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
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM50031937
PNG
(7-Piperazin-1-yl-6H-5-oxa-8-aza-benzo[c]phenanthre...)
Show SMILES C1CN(CCN1)c1nc2ccccc2c-2c1COc1ccccc-21
Show InChI InChI=1S/C20H19N3O/c1-3-7-17-14(5-1)19-15-6-2-4-8-18(15)24-13-16(19)20(22-17)23-11-9-21-10-12-23/h1-8,21H,9-13H2
PDB

UniProtKB/SwissProt

GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
11n/an/an/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Rat 5-hydroxytryptamine 3 receptor (5-HT3) antagonist


J Med Chem 41: 2029-39 (1998)


Article DOI: 10.1021/jm970745o
BindingDB Entry DOI: 10.7270/Q2CJ8H7X
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 3A/3B


(Rattus norvegicus-RAT)
BDBM50031937
PNG
(7-Piperazin-1-yl-6H-5-oxa-8-aza-benzo[c]phenanthre...)
Show SMILES C1CN(CCN1)c1nc2ccccc2c-2c1COc1ccccc-21
Show InChI InChI=1S/C20H19N3O/c1-3-7-17-14(5-1)19-15-6-2-4-8-18(15)24-13-16(19)20(22-17)23-11-9-21-10-12-23/h1-8,21H,9-13H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
12n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for 5-hydroxytryptamine 3 receptor from rat cortex using [3H]BRL-43694 as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50031937
PNG
(7-Piperazin-1-yl-6H-5-oxa-8-aza-benzo[c]phenanthre...)
Show SMILES C1CN(CCN1)c1nc2ccccc2c-2c1COc1ccccc-21
Show InChI InChI=1S/C20H19N3O/c1-3-7-17-14(5-1)19-15-6-2-4-8-18(15)24-13-16(19)20(22-17)23-11-9-21-10-12-23/h1-8,21H,9-13H2
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
360n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Effect of compound on Serotonin transporter uptake from rat cortex using [3H]citalopram as radioligand


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50031937
PNG
(7-Piperazin-1-yl-6H-5-oxa-8-aza-benzo[c]phenanthre...)
Show SMILES C1CN(CCN1)c1nc2ccccc2c-2c1COc1ccccc-21
Show InChI InChI=1S/C20H19N3O/c1-3-7-17-14(5-1)19-15-6-2-4-8-18(15)24-13-16(19)20(22-17)23-11-9-21-10-12-23/h1-8,21H,9-13H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
2.80E+3n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity to 5-hydroxytryptamine 2A receptor from rat cortex assayed using [3H]ketanserin as radioligand.


J Med Chem 38: 2692-704 (1995)


BindingDB Entry DOI: 10.7270/Q27H1K7H
More data for this
Ligand-Target Pair