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BDBM50378189 CHEMBL4164250

SMILES: COc1cc(CNCCC2=CCCCC2)ccc1OCc1ccccc1

InChI Key: InChIKey=RBVCWAULFGDWPZ-UHFFFAOYSA-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 = 50378189   
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 6


(Homo sapiens (Human))
BDBM50378189
PNG
(CHEMBL4164250)
Show SMILES COc1cc(CNCCC2=CCCCC2)ccc1OCc1ccccc1 |t:9|
Show InChI InChI=1S/C23H29NO2/c1-25-23-16-21(17-24-15-14-19-8-4-2-5-9-19)12-13-22(23)26-18-20-10-6-3-7-11-20/h3,6-8,10-13,16,24H,2,4-5,9,14-15,17-18H2,1H3
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Similars

Article
PubMed
2.70E+3n/an/an/an/an/an/an/an/a



Polish Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from human 5-HT6 receptor expressed in HEK293 cell membranes after 1 hr by microbeta TopCount analysis


Eur J Med Chem 151: 797-814 (2018)


Article DOI: 10.1016/j.ejmech.2018.04.010
BindingDB Entry DOI: 10.7270/Q2W098H4
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50378189
PNG
(CHEMBL4164250)
Show SMILES COc1cc(CNCCC2=CCCCC2)ccc1OCc1ccccc1 |t:9|
Show InChI InChI=1S/C23H29NO2/c1-25-23-16-21(17-24-15-14-19-8-4-2-5-9-19)12-13-22(23)26-18-20-10-6-3-7-11-20/h3,6-8,10-13,16,24H,2,4-5,9,14-15,17-18H2,1H3
PDB

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antibodypedia
GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem

Similars

Article
PubMed
4.90E+3n/an/an/an/an/an/an/an/a



Polish Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]-8-OH-DPAT from human 5-HT1A receptor expressed in HEK293 cell membranes after 1 hr by microbeta TopCount analysis


Eur J Med Chem 151: 797-814 (2018)


Article DOI: 10.1016/j.ejmech.2018.04.010
BindingDB Entry DOI: 10.7270/Q2W098H4
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 7


(Homo sapiens (Human))
BDBM50378189
PNG
(CHEMBL4164250)
Show SMILES COc1cc(CNCCC2=CCCCC2)ccc1OCc1ccccc1 |t:9|
Show InChI InChI=1S/C23H29NO2/c1-25-23-16-21(17-24-15-14-19-8-4-2-5-9-19)12-13-22(23)26-18-20-10-6-3-7-11-20/h3,6-8,10-13,16,24H,2,4-5,9,14-15,17-18H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

Article
PubMed
8.00E+3n/an/an/an/an/an/an/an/a



Polish Academy of Sciences

Curated by ChEMBL


Assay Description
Displacement of [3H]-5-CT from human 5-HT7b receptor expressed in HEK293 cell membranes after 1 hr by microbeta TopCount analysis


Eur J Med Chem 151: 797-814 (2018)


Article DOI: 10.1016/j.ejmech.2018.04.010
BindingDB Entry DOI: 10.7270/Q2W098H4
More data for this
Ligand-Target Pair