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SMILES: C[C@H](NC(=O)N1C[C@@H]2C[C@H]1CN2CCCOc1ccc(cc1)C(=O)C1CC1)C(O)=O

InChI Key: InChIKey=XLQIXQOAVGBSPU-WBAXXEDZSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50119727   
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
Histamine H3 receptor


(Rattus norvegicus (rat))		BDBM50119727
PNG
((S)-2-({(2S,7S)-5-[3-(4-Cyclopropanecarbonyl-pheno...)
Show SMILES C[C@H](NC(=O)N1C[C@@H]2C[C@H]1CN2CCCOc1ccc(cc1)C(=O)C1CC1)C(O)=O
Show InChI InChI=1S/C22H29N3O5/c1-14(21(27)28)23-22(29)25-13-17-11-18(25)12-24(17)9-2-10-30-19-7-5-16(6-8-19)20(26)15-3-4-15/h5-8,14-15,17-18H,2-4,9-13H2,1H3,(H,23,29)(H,27,28)/t14-,17-,18-/m0/s1
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PC sid
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Similars
PubMed
 232n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity against rat histamine H3 receptor

Bioorg Med Chem Lett 12: 3055-8 (2002)


BindingDB Entry DOI: 10.7270/Q2B56J3P
More data for this
Ligand-Target Pair