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BDBM50313917 6-Methyl-5,6,7,8,13,15-hexahydro-4H-indolo[4,3a,3-fg][3]benzazacycloundecene::CHEMBL1087300

SMILES: CN1CCc2ccccc2Cc2c[nH]c3cccc(CC1)c23

InChI Key: InChIKey=MSXGPWPTXORIBR-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50313917   
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
Dopamine D5 receptor


(Homo sapiens (Human))
BDBM50313917
PNG
(6-Methyl-5,6,7,8,13,15-hexahydro-4H-indolo[4,3a,3-...)
Show SMILES CN1CCc2ccccc2Cc2c[nH]c3cccc(CC1)c23
Show InChI InChI=1S/C20H22N2/c1-22-11-9-15-5-2-3-6-17(15)13-18-14-21-19-8-4-7-16(10-12-22)20(18)19/h2-8,14,21H,9-13H2,1H3
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
2.5n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]radioligand from human recombinant dopamine D5 receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50313917
PNG
(6-Methyl-5,6,7,8,13,15-hexahydro-4H-indolo[4,3a,3-...)
Show SMILES CN1CCc2ccccc2Cc2c[nH]c3cccc(CC1)c23
Show InChI InChI=1S/C20H22N2/c1-22-11-9-15-5-2-3-6-17(15)13-18-14-21-19-8-4-7-16(10-12-22)20(18)19/h2-8,14,21H,9-13H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
4n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human recombinant dopamine D2L receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(Homo sapiens (Human))
BDBM50313917
PNG
(6-Methyl-5,6,7,8,13,15-hexahydro-4H-indolo[4,3a,3-...)
Show SMILES CN1CCc2ccccc2Cc2c[nH]c3cccc(CC1)c23
Show InChI InChI=1S/C20H22N2/c1-22-11-9-15-5-2-3-6-17(15)13-18-14-21-19-8-4-7-16(10-12-22)20(18)19/h2-8,14,21H,9-13H2,1H3
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
4.20n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]SCH23390 from human recombinant dopamine D1 receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50313917
PNG
(6-Methyl-5,6,7,8,13,15-hexahydro-4H-indolo[4,3a,3-...)
Show SMILES CN1CCc2ccccc2Cc2c[nH]c3cccc(CC1)c23
Show InChI InChI=1S/C20H22N2/c1-22-11-9-15-5-2-3-6-17(15)13-18-14-21-19-8-4-7-16(10-12-22)20(18)19/h2-8,14,21H,9-13H2,1H3
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
42.9n/an/an/an/an/an/an/an/a



Friedrich-Schiller-Universit£t Jena

Curated by ChEMBL


Assay Description
Displacement of [3H]radioligand from human recombinant dopamine D3 receptor expressed in HEK293 cells by microplate scintillation counting


J Med Chem 53: 2646-50 (2010)


Article DOI: 10.1021/jm901291r
BindingDB Entry DOI: 10.7270/Q2SJ1KRJ
More data for this
Ligand-Target Pair