Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Gamma-aminobutyric acid (GABA) B receptor 1' and Ligand = 'BDBM104978'   

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
Gamma-aminobutyric acid (GABA) B receptor 1 (Rattus norvegicus (rat))	BDBM104978 (US8575375, C-8) Show SMILES CN(C)c1ccc(cc1)[C@H]1C[C@@]2(C)C(CC[C@@H]2[N+]([O-])=O)C2CC[C@H]3C[C@](C)(O)CCC3C12 |r| Show InChI InChI=1S/C27H40N2O3/c1-26(30)14-13-20-18(15-26)7-10-21-23-11-12-24(29(31)32)27(23,2)16-22(25(20)21)17-5-8-19(9-6-17)28(3)4/h5-6,8-9,18,20-25,30H,7,10-16H2,1-4H3/t18-,20?,21?,22+,23?,24-,25?,26+,27-/m0/s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	9.79	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute; The United States of America, as represented by the Secretary, Department of Health and Human Services US Patent					Assay Description [35S]TBPS binding assay.				US Patent US8575375 (2013) BindingDB Entry DOI: 10.7270/Q2ST7NGT
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