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SMILES: N[C@H]1C[C@@H](C1)c1c[nH]c2ccc(Oc3ccccc3)cc12

InChI Key: InChIKey=KUJBWNONBWTAMM-JOCQHMNTSA-N

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 2 hits for monomerid = 50473512   
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 1B


(Homo sapiens (Human))
BDBM50473512
PNG
(CHEMBL2368254)
Show SMILES N[C@H]1C[C@@H](C1)c1c[nH]c2ccc(Oc3ccccc3)cc12 |wU:1.0,wD:3.5,(12.4,-12.84,;11.92,-11.37,;10.55,-10.69,;11.23,-9.32,;12.61,-9.99,;10.76,-7.85,;11.65,-6.6,;10.74,-5.35,;9.27,-5.84,;7.94,-5.07,;6.61,-5.86,;6.61,-7.4,;5.27,-8.17,;5.27,-9.71,;6.6,-10.46,;6.61,-12,;5.27,-12.79,;3.93,-12,;3.94,-10.46,;7.94,-8.17,;9.29,-7.38,)|
Show InChI InChI=1S/C18H18N2O/c19-13-8-12(9-13)17-11-20-18-7-6-15(10-16(17)18)21-14-4-2-1-3-5-14/h1-7,10-13,20H,8-9,19H2/t12-,13-
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PC cid
PC sid
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Article
PubMed
n/an/a 9.5n/an/an/an/an/an/a



GlaxoWellcome

Curated by ChEMBL


Assay Description
Binding affinity in CHO-K1 cells transfected with human recombinant 5-hydroxytryptamine 1B receptor


J Med Chem 44: 681-93 (2001)


Article DOI: 10.1021/jm000956k
BindingDB Entry DOI: 10.7270/Q2PC354M
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1D


(Homo sapiens (Human))
BDBM50473512
PNG
(CHEMBL2368254)
Show SMILES N[C@H]1C[C@@H](C1)c1c[nH]c2ccc(Oc3ccccc3)cc12 |wU:1.0,wD:3.5,(12.4,-12.84,;11.92,-11.37,;10.55,-10.69,;11.23,-9.32,;12.61,-9.99,;10.76,-7.85,;11.65,-6.6,;10.74,-5.35,;9.27,-5.84,;7.94,-5.07,;6.61,-5.86,;6.61,-7.4,;5.27,-8.17,;5.27,-9.71,;6.6,-10.46,;6.61,-12,;5.27,-12.79,;3.93,-12,;3.94,-10.46,;7.94,-8.17,;9.29,-7.38,)|
Show InChI InChI=1S/C18H18N2O/c19-13-8-12(9-13)17-11-20-18-7-6-15(10-16(17)18)21-14-4-2-1-3-5-14/h1-7,10-13,20H,8-9,19H2/t12-,13-
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 14n/an/an/an/an/an/a



GlaxoWellcome

Curated by ChEMBL


Assay Description
Binding affinity in CHO-K1 cells transfected with human 5-hydroxytryptamine 1D receptor


J Med Chem 44: 681-93 (2001)


Article DOI: 10.1021/jm000956k
BindingDB Entry DOI: 10.7270/Q2PC354M
More data for this
Ligand-Target Pair