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BDBM50375929 CHEMBL259001

SMILES: CCOc1ccccc1N1CCN(CCCC(=O)NCc2nc3ccc(F)cc3c(=O)n2-c2ccccc2OC)CC1

InChI Key: InChIKey=RSUVPDKLBVYZSF-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50375929   
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))
BDBM50375929
PNG
(CHEMBL259001)
Show SMILES CCOc1ccccc1N1CCN(CCCC(=O)NCc2nc3ccc(F)cc3c(=O)n2-c2ccccc2OC)CC1
Show InChI InChI=1S/C32H36FN5O4/c1-3-42-29-12-7-4-9-26(29)37-19-17-36(18-20-37)16-8-13-31(39)34-22-30-35-25-15-14-23(33)21-24(25)32(40)38(30)27-10-5-6-11-28(27)41-2/h4-7,9-12,14-15,21H,3,8,13,16-20,22H2,1-2H3,(H,34,39)
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 48.0n/an/an/an/an/an/a



Sharif University of Technology

Curated by ChEMBL


Assay Description
Inhibition of 5HT7 receptor by radioligand binding assay


Eur J Med Chem 44: 1463-70 (2009)


Article DOI: 10.1016/j.ejmech.2008.09.050
BindingDB Entry DOI: 10.7270/Q2QV3NRM
More data for this
Ligand-Target Pair
5-Hydroxytryptamine receptor 7 (5-HT7)


(Homo sapiens (Human))
BDBM50375929
PNG
(CHEMBL259001)
Show SMILES CCOc1ccccc1N1CCN(CCCC(=O)NCc2nc3ccc(F)cc3c(=O)n2-c2ccccc2OC)CC1
Show InChI InChI=1S/C32H36FN5O4/c1-3-42-29-12-7-4-9-26(29)37-19-17-36(18-20-37)16-8-13-31(39)34-22-30-35-25-15-14-23(33)21-24(25)32(40)38(30)27-10-5-6-11-28(27)41-2/h4-7,9-12,14-15,21H,3,8,13,16-20,22H2,1-2H3,(H,34,39)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 48n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from human recombinant 5HT7 receptor


Bioorg Med Chem 16: 2570-8 (2008)


Article DOI: 10.1016/j.bmc.2007.11.049
BindingDB Entry DOI: 10.7270/Q2JW8FRT
More data for this
Ligand-Target Pair