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BDBM50081993 7-Methyl-4-(4-methyl-piperazin-1-yl)-pyrrolo[1,2-a]quinoxaline::CHEMBL422279

SMILES: CN1CCN(CC1)c1nc2cc(C)ccc2n2cccc12

InChI Key: InChIKey=FBYTVJACOAVEGV-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50081993   
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
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Rattus norvegicus-RAT)
BDBM50081993
PNG
(7-Methyl-4-(4-methyl-piperazin-1-yl)-pyrrolo[1,2-a...)
Show SMILES CN1CCN(CC1)c1nc2cc(C)ccc2n2cccc12
Show InChI InChI=1S/C17H20N4/c1-13-5-6-15-14(12-13)18-17(16-4-3-7-21(15)16)20-10-8-19(2)9-11-20/h3-7,12H,8-11H2,1-2H3
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Similars

Article
PubMed
n/an/a 18n/an/an/an/an/an/a



Universita' degli Studi di Salerno

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 3 (5-HT3) receptor from rat cortical homogenate using [3H]-zacopride as radioligand


J Med Chem 42: 4362-79 (1999)


Article DOI: 10.1021/jm990151g
BindingDB Entry DOI: 10.7270/Q2S75FJM
More data for this
Ligand-Target Pair
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor


(Homo sapiens (Human))
BDBM50081993
PNG
(7-Methyl-4-(4-methyl-piperazin-1-yl)-pyrrolo[1,2-a...)
Show SMILES CN1CCN(CC1)c1nc2cc(C)ccc2n2cccc12
Show InChI InChI=1S/C17H20N4/c1-13-5-6-15-14(12-13)18-17(16-4-3-7-21(15)16)20-10-8-19(2)9-11-20/h3-7,12H,8-11H2,1-2H3
PDB
MMDB

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GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 14n/an/an/an/a



Universita' degli Studi di Salerno

Curated by ChEMBL


Assay Description
Effective concentration against 5-Hydroxytryptamine 3 receptor by measuring [14C]-guanidinium uptake on NG108-15 cells.


J Med Chem 42: 4362-79 (1999)


Article DOI: 10.1021/jm990151g
BindingDB Entry DOI: 10.7270/Q2S75FJM
More data for this
Ligand-Target Pair