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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 1B' and Ligand = 'BDBM82562'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
5-hydroxytryptamine receptor 1B


(Rattus norvegicus (Rat))
BDBM82562
PNG
(CAS_182595 | NSC_182595 | S 14489)
Show SMILES C(CN1CCN(CC1)c1cccc2OCCOc12)C1Cc2ccccc12
Show InChI InChI=1S/C22H26N2O2/c1-2-5-19-17(4-1)16-18(19)8-9-23-10-12-24(13-11-23)20-6-3-7-21-22(20)26-15-14-25-21/h1-7,18H,8-16H2
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PC cid
PC sid
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Similars

PubMed
603n/an/an/an/an/an/an/an/a



Institut de Recherches Servier

Curated by PDSP Ki Database




J Pharmacol Exp Ther 268: 337-52 (1994)


BindingDB Entry DOI: 10.7270/Q2H130HG
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1B


(Rattus norvegicus (Rat))
BDBM82562
PNG
(CAS_182595 | NSC_182595 | S 14489)
Show SMILES C(CN1CCN(CC1)c1cccc2OCCOc12)C1Cc2ccccc12
Show InChI InChI=1S/C22H26N2O2/c1-2-5-19-17(4-1)16-18(19)8-9-23-10-12-24(13-11-23)20-6-3-7-21-22(20)26-15-14-25-21/h1-7,18H,8-16H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PubMed
603n/an/an/an/an/an/an/an/a



Institut de Recherches Servier

Curated by ChEMBL


Assay Description
Binding affinity at 5-hydroxytryptamine 1B receptor


J Med Chem 38: 4044-55 (1995)


BindingDB Entry DOI: 10.7270/Q2KP83C0
More data for this
Ligand-Target Pair