Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histamine receptor H3' and Ligand = 'BDBM247453'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Histamine receptor H3 (Macaca mulatta (Rhesus macaque))	BDBM247453 (US9453023, 12) Show SMILES C[C@H]1CCCN1[C@H]1CC[C@@H](CC1)c1ccc(cc1)N1CCC2(CCOCC2)C1=O |r,wU:9.13,wD:6.6,1.0,(6.5,-3.36,;7.27,-2.02,;8.74,-1.55,;8.74,-.01,;7.27,.47,;6.37,-.78,;4.83,-.78,;4.06,.56,;2.52,.56,;1.75,-.78,;2.52,-2.11,;4.06,-2.11,;.21,-.78,;-.56,-2.11,;-2.1,-2.11,;-2.87,-.78,;-2.1,.56,;-.56,.56,;-4.41,-.78,;-5.66,-1.68,;-6.9,-.78,;-6.43,.69,;-5.66,2.02,;-6.43,3.36,;-7.97,3.36,;-8.74,2.02,;-7.97,.69,;-4.89,.69,;-4.12,2.02,)| Show InChI InChI=1S/C25H36N2O2/c1-19-3-2-15-26(19)22-8-4-20(5-9-22)21-6-10-23(11-7-21)27-16-12-25(24(27)28)13-17-29-18-14-25/h6-7,10-11,19-20,22H,2-5,8-9,12-18H2,1H3/t19-,20-,22-/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	6.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Rhesus H3 radioligand binding assay was performed using rhesus H3 receptor membranes (prepared as described above), [3H]-Methylhistamine (Perkin Elme...				US Patent US9453023 (2016) BindingDB Entry DOI: 10.7270/Q2XD10MK
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