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BDBM84993 5,6,7,8,9,10-Hexahydro-2-(4-methoxyphenyl)cyclohepta[b]pyrazolo[3,4-d]pyridin-3(2H)-one::CGS 20625::CGS-20625

SMILES: COc1ccc(cc1)-n1[nH]c2c3CCCCCc3ncc2c1=O

InChI Key: InChIKey=UBLXQFIFWUEVGJ-UHFFFAOYSA-N

Data: 3 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 84993   
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
Gamma-aminobutyric acid receptor subunit alpha-1


(Homo sapiens (Human))
BDBM84993
PNG
(5,6,7,8,9,10-Hexahydro-2-(4-methoxyphenyl)cyclohep...)
Show SMILES COc1ccc(cc1)-n1[nH]c2c3CCCCCc3ncc2c1=O
Show InChI InChI=1S/C18H19N3O2/c1-23-13-9-7-12(8-10-13)21-18(22)15-11-19-16-6-4-2-3-5-14(16)17(15)20-21/h7-11,20H,2-6H2,1H3
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Article
PubMed
0.150n/an/an/an/an/an/an/an/a



University Clinic for Psychiatry

Curated by PDSP Ki Database




Eur J Pharmacol 304: 155-62 (1996)


Article DOI: 10.1016/0014-2999(96)00088-x
BindingDB Entry DOI: 10.7270/Q2HD7T6P
More data for this
Ligand-Target Pair
GABA A Alpha4Beta2Gamma2


(Homo sapiens (Human))
BDBM84993
PNG
(5,6,7,8,9,10-Hexahydro-2-(4-methoxyphenyl)cyclohep...)
Show SMILES COc1ccc(cc1)-n1[nH]c2c3CCCCCc3ncc2c1=O
Show InChI InChI=1S/C18H19N3O2/c1-23-13-9-7-12(8-10-13)21-18(22)15-11-19-16-6-4-2-3-5-14(16)17(15)20-21/h7-11,20H,2-6H2,1H3
Reactome pathway
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Article
PubMed
22.4n/an/an/an/an/an/an/an/a



University Clinic for Psychiatry

Curated by PDSP Ki Database




Eur J Pharmacol 304: 155-62 (1996)


Article DOI: 10.1016/0014-2999(96)00088-x
BindingDB Entry DOI: 10.7270/Q2HD7T6P
More data for this
Ligand-Target Pair
GABA A Alpha4Beta2Gamma2


(Homo sapiens (Human))
BDBM84993
PNG
(5,6,7,8,9,10-Hexahydro-2-(4-methoxyphenyl)cyclohep...)
Show SMILES COc1ccc(cc1)-n1[nH]c2c3CCCCCc3ncc2c1=O
Show InChI InChI=1S/C18H19N3O2/c1-23-13-9-7-12(8-10-13)21-18(22)15-11-19-16-6-4-2-3-5-14(16)17(15)20-21/h7-11,20H,2-6H2,1H3
Reactome pathway
KEGG

DrugBank
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
77n/an/an/an/an/an/an/an/a



University Clinic for Psychiatry

Curated by PDSP Ki Database




Eur J Pharmacol 304: 155-62 (1996)


Article DOI: 10.1016/0014-2999(96)00088-x
BindingDB Entry DOI: 10.7270/Q2HD7T6P
More data for this
Ligand-Target Pair