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SMILES: CCCC(c1ccncc1)n1ccc2ccccc12

InChI Key: InChIKey=QHMFRKMGCLKZRZ-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50454302   
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
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50454302
PNG
(CHEMBL347199)
Show SMILES CCCC(c1ccncc1)n1ccc2ccccc12
Show InChI InChI=1S/C17H18N2/c1-2-5-16(15-8-11-18-12-9-15)19-13-10-14-6-3-4-7-17(14)19/h3-4,6-13,16H,2,5H2,1H3
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UniProtKB/SwissProt

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antibodypedia
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 670n/an/an/an/an/an/a



Hoechst-Roussel Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against norepinephrine (NE) uptake in rat whole brain synaptosome preparation


J Med Chem 39: 570-81 (1996)


Article DOI: 10.1021/jm9506433
BindingDB Entry DOI: 10.7270/Q2BR8R7K
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50454302
PNG
(CHEMBL347199)
Show SMILES CCCC(c1ccncc1)n1ccc2ccccc12
Show InChI InChI=1S/C17H18N2/c1-2-5-16(15-8-11-18-12-9-15)19-13-10-14-6-3-4-7-17(14)19/h3-4,6-13,16H,2,5H2,1H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.90E+4n/an/an/an/an/an/a



Hoechst-Roussel Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of [3H]quinuclidinyl benzilate (QNB) binding from rat forebrain membranes in the presence of Zn


J Med Chem 39: 570-81 (1996)


Article DOI: 10.1021/jm9506433
BindingDB Entry DOI: 10.7270/Q2BR8R7K
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50454302
PNG
(CHEMBL347199)
Show SMILES CCCC(c1ccncc1)n1ccc2ccccc12
Show InChI InChI=1S/C17H18N2/c1-2-5-16(15-8-11-18-12-9-15)19-13-10-14-6-3-4-7-17(14)19/h3-4,6-13,16H,2,5H2,1H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.42E+5n/an/an/an/an/an/a



Hoechst-Roussel Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of [3H]quinuclidinyl benzilate (QNB) binding from rat forebrain membranes in the absence of Zn


J Med Chem 39: 570-81 (1996)


Article DOI: 10.1021/jm9506433
BindingDB Entry DOI: 10.7270/Q2BR8R7K
More data for this
Ligand-Target Pair