null

SMILES: COC[C@]12CC[C@@](C)(O)C[C@H]1CC[C@H]1[C@@H]3CC[C@H](C(=O)Cn4nc5ccc(Cl)cc5n4)[C@@]3(C)CC[C@H]21

InChI Key: InChIKey=NBRZDFUBHOXBTE-TXLWSPTFSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 403328   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Gamma-aminobutyric acid (GABA) B receptor 1 (Rattus norvegicus (rat))	BDBM403328 (US10329320, Compound 1 | US10329320, Compound 2) Show SMILES COC[C@]12CC[C@@](C)(O)C[C@H]1CC[C@H]1[C@@H]3CC[C@H](C(=O)Cn4nc5ccc(Cl)cc5n4)[C@@]3(C)CC[C@H]21 |r| Show InChI InChI=1S/C29H40ClN3O3/c1-27(35)12-13-29(17-36-3)18(15-27)4-6-20-21-7-8-23(28(21,2)11-10-22(20)29)26(34)16-33-31-24-9-5-19(30)14-25(24)32-33/h5,9,14,18,20-23,35H,4,6-8,10-13,15-17H2,1-3H3/t18-,20+,21+,22+,23-,27-,28+,29-/m1/s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
SRMLSC Curated by PubChem BioAssay					Assay Description TBPS binding assays using rat brain cortical membranes in the presence of 5 μM GABA has been described (Gee et al, J. Pharmacol. Exp. Ther. 1987...				PubChem Bioassay (2006) BindingDB Entry DOI: 10.7270/Q22N54NV
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid (GABA) B receptor 1 (Rattus norvegicus (rat))	BDBM403328 (US10329320, Compound 1 | US10329320, Compound 2) Show SMILES COC[C@]12CC[C@@](C)(O)C[C@H]1CC[C@H]1[C@@H]3CC[C@H](C(=O)Cn4nc5ccc(Cl)cc5n4)[C@@]3(C)CC[C@H]21 |r| Show InChI InChI=1S/C29H40ClN3O3/c1-27(35)12-13-29(17-36-3)18(15-27)4-6-20-21-7-8-23(28(21,2)11-10-22(20)29)26(34)16-33-31-24-9-5-19(30)14-25(24)32-33/h5,9,14,18,20-23,35H,4,6-8,10-13,15-17H2,1-3H3/t18-,20+,21+,22+,23-,27-,28+,29-/m1/s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
SRMLSC Curated by PubChem BioAssay					Assay Description TBPS binding assays using rat brain cortical membranes in the presence of 5 μM GABA has been described (Gee et al, J. Pharmacol. Exp. Ther. 1987...				PubChem Bioassay (2006) BindingDB Entry DOI: 10.7270/Q22N54NV
					More data for this Ligand-Target Pair