Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histamine receptor H3' and Ligand = 'BDBM247455'   

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))	BDBM247455 (US9453023, 14) Show SMILES C[C@@H]1CCCN1[C@H]1CC[C@@H](CC1)c1ccc(N2CCC3(CCN(CC3)C(=O)OC(C)(C)C)C2=O)c(F)c1 |r,wU:9.13,1.0,wD:6.6,(9.66,-3.21,;10.43,-1.88,;11.9,-1.41,;11.9,.13,;10.43,.61,;9.53,-.64,;7.99,-.64,;7.22,.7,;5.68,.7,;4.91,-.64,;5.68,-1.97,;7.22,-1.97,;3.37,-.64,;2.6,-1.97,;1.06,-1.97,;.29,-.64,;-1.25,-.64,;-1.73,-2.1,;-3.27,-2.1,;-3.74,-.64,;-5.08,-1.41,;-6.41,-.64,;-6.41,.9,;-5.08,1.67,;-3.74,.9,;-7.74,1.67,;-7.74,3.21,;-9.08,.9,;-10.41,1.67,;-10.81,3.16,;-11.9,2.07,;-11.5,.59,;-2.5,.27,;-2.5,1.81,;1.06,.7,;.29,2.03,;2.6,.7,)| Show InChI InChI=1S/C30H44FN3O3/c1-21-6-5-16-33(21)24-10-7-22(8-11-24)23-9-12-26(25(31)20-23)34-19-15-30(27(34)35)13-17-32(18-14-30)28(36)37-29(2,3)4/h9,12,20-22,24H,5-8,10-11,13-19H2,1-4H3/t21-,22-,24-/m1/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	6.61	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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