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BDBM50206171 (E)-6-((3,4-dihydroisoquinolin-2(1H)-yl)methyleneamino)-2,3-dihydro-1H-inden-1-ol::CHEMBL442093

SMILES: OC1CCc2ccc(cc12)\N=C\N1CCc2ccccc2C1

InChI Key: InChIKey=NRDCOYNEQGSTGB-DEDYPNTBNA-N

Data: 3 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 3 hits for monomerid = 50206171   
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 7 (5-HT7)


(Homo sapiens (Human))
BDBM50206171
PNG
((E)-6-((3,4-dihydroisoquinolin-2(1H)-yl)methylenea...)
Show SMILES OC1CCc2ccc(cc12)\N=C\N1CCc2ccccc2C1
Show InChI InChI=1/C19H20N2O/c22-19-8-6-15-5-7-17(11-18(15)19)20-13-21-10-9-14-3-1-2-4-16(14)12-21/h1-5,7,11,13,19,22H,6,8-10,12H2/b20-13+
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Article
PubMed
2.70E+3n/an/an/an/an/an/an/an/a



University of Strathclyde

Curated by ChEMBL


Assay Description
Displacement of [3H]5CT from 5HT7 receptor expressed in HEK293 cells


Bioorg Med Chem Lett 17: 2649-55 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.093
BindingDB Entry DOI: 10.7270/Q2WQ03F0
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM50206171
PNG
((E)-6-((3,4-dihydroisoquinolin-2(1H)-yl)methylenea...)
Show SMILES OC1CCc2ccc(cc12)\N=C\N1CCc2ccccc2C1
Show InChI InChI=1/C19H20N2O/c22-19-8-6-15-5-7-17(11-18(15)19)20-13-21-10-9-14-3-1-2-4-16(14)12-21/h1-5,7,11,13,19,22H,6,8-10,12H2/b20-13+
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PC sid
UniChem

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



University of Strathclyde

Curated by ChEMBL


Assay Description
Displacement of [3H]N-methylscopolamine from muscarinic M4 receptor


Bioorg Med Chem Lett 17: 2649-55 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.093
BindingDB Entry DOI: 10.7270/Q2WQ03F0
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50206171
PNG
((E)-6-((3,4-dihydroisoquinolin-2(1H)-yl)methylenea...)
Show SMILES OC1CCc2ccc(cc12)\N=C\N1CCc2ccccc2C1
Show InChI InChI=1/C19H20N2O/c22-19-8-6-15-5-7-17(11-18(15)19)20-13-21-10-9-14-3-1-2-4-16(14)12-21/h1-5,7,11,13,19,22H,6,8-10,12H2/b20-13+
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
>3.00E+5n/an/an/an/an/an/an/an/a



University of Strathclyde

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from dopamine D2 receptor


Bioorg Med Chem Lett 17: 2649-55 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.093
BindingDB Entry DOI: 10.7270/Q2WQ03F0
More data for this
Ligand-Target Pair