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BDBM50035310 (1-Methyl-6,7,8,9-tetrahydro-3H-benzo[e]indol-8-yl)-dipropyl-amine::CHEMBL69562

SMILES: CCCN(CCC)C1CCc2ccc3[nH]cc(C)c3c2C1

InChI Key: InChIKey=BLMNALZUWKHXKM-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 50035310   
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
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50035310
PNG
((1-Methyl-6,7,8,9-tetrahydro-3H-benzo[e]indol-8-yl...)
Show SMILES CCCN(CCC)C1CCc2ccc3[nH]cc(C)c3c2C1
Show InChI InChI=1S/C19H28N2/c1-4-10-21(11-5-2)16-8-6-15-7-9-18-19(17(15)12-16)14(3)13-20-18/h7,9,13,16,20H,4-6,8,10-12H2,1-3H3
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PubMed
13n/an/an/an/an/an/an/an/a



Göteborg University

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 1A receptor from CHO-K1 cells, using [3H]-8-OH-DPAT as the radioligand.


J Med Chem 38: 2202-16 (1995)


Article DOI: 10.1021/jm00012a021
BindingDB Entry DOI: 10.7270/Q24T6HD0
More data for this
Ligand-Target Pair
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50035310
PNG
((1-Methyl-6,7,8,9-tetrahydro-3H-benzo[e]indol-8-yl...)
Show SMILES CCCN(CCC)C1CCc2ccc3[nH]cc(C)c3c2C1
Show InChI InChI=1S/C19H28N2/c1-4-10-21(11-5-2)16-8-6-15-7-9-18-19(17(15)12-16)14(3)13-20-18/h7,9,13,16,20H,4-6,8,10-12H2,1-3H3
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14n/an/an/an/an/an/an/an/a



Göteborg University

Curated by ChEMBL


Assay Description
Binding affinity against Dopamine receptor D2 expressed in CHO-K1 cells, using [3H]-U-86,170 as the radioligand.


J Med Chem 38: 2202-16 (1995)


Article DOI: 10.1021/jm00012a021
BindingDB Entry DOI: 10.7270/Q24T6HD0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1D


(Homo sapiens (Human))
BDBM50035310
PNG
((1-Methyl-6,7,8,9-tetrahydro-3H-benzo[e]indol-8-yl...)
Show SMILES CCCN(CCC)C1CCc2ccc3[nH]cc(C)c3c2C1
Show InChI InChI=1S/C19H28N2/c1-4-10-21(11-5-2)16-8-6-15-7-9-18-19(17(15)12-16)14(3)13-20-18/h7,9,13,16,20H,4-6,8,10-12H2,1-3H3
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43n/an/an/an/an/an/an/an/a



Göteborg University

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 1D receptor alpha expressed in CHO-K1 cells, using [3H]-5-HT as the radioligand.


J Med Chem 38: 2202-16 (1995)


Article DOI: 10.1021/jm00012a021
BindingDB Entry DOI: 10.7270/Q24T6HD0
More data for this
Ligand-Target Pair
Dopamine receptor


(Rattus norvegicus (Rat))
BDBM50035310
PNG
((1-Methyl-6,7,8,9-tetrahydro-3H-benzo[e]indol-8-yl...)
Show SMILES CCCN(CCC)C1CCc2ccc3[nH]cc(C)c3c2C1
Show InChI InChI=1S/C19H28N2/c1-4-10-21(11-5-2)16-8-6-15-7-9-18-19(17(15)12-16)14(3)13-20-18/h7,9,13,16,20H,4-6,8,10-12H2,1-3H3
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67n/an/an/an/an/an/an/an/a



Göteborg University

Curated by ChEMBL


Assay Description
Binding affinity against Dopamine receptor D3 expressed in CHO-K1 cells, using [3H]-spiperone as the radioligand.


J Med Chem 38: 2202-16 (1995)


Article DOI: 10.1021/jm00012a021
BindingDB Entry DOI: 10.7270/Q24T6HD0
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1B


(Homo sapiens (Human))
BDBM50035310
PNG
((1-Methyl-6,7,8,9-tetrahydro-3H-benzo[e]indol-8-yl...)
Show SMILES CCCN(CCC)C1CCc2ccc3[nH]cc(C)c3c2C1
Show InChI InChI=1S/C19H28N2/c1-4-10-21(11-5-2)16-8-6-15-7-9-18-19(17(15)12-16)14(3)13-20-18/h7,9,13,16,20H,4-6,8,10-12H2,1-3H3
PDB

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Article
PubMed
789n/an/an/an/an/an/an/an/a



Göteborg University

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 1D receptor beta expressed in CHO-K1 cells, using [3H]-5-HT as the radioligand.


J Med Chem 38: 2202-16 (1995)


Article DOI: 10.1021/jm00012a021
BindingDB Entry DOI: 10.7270/Q24T6HD0
More data for this
Ligand-Target Pair