BDBM104976 US8575375, A2-B

SMILES: C[C@]12CCC3C(CC[C@H]4C[C@](C)(O)CC[C@]34C)C1CC[C@@H]2[N+]([O-])=O

InChI Key: InChIKey=SCLZOWKUTFYLGM-UOXHNUPUSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 104976   

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 Type B Receptor Subunit 1 (Rattus norvegicus (rat))	BDBM104976 (US8575375, A2-B) Show SMILES C[C@]12CCC3C(CC[C@H]4C[C@](C)(O)CC[C@]34C)C1CC[C@@H]2[N+]([O-])=O |r| Show InChI InChI=1S/C20H33NO3/c1-18(22)10-11-19(2)13(12-18)4-5-14-15-6-7-17(21(23)24)20(15,3)9-8-16(14)19/h13-17,22H,4-12H2,1-3H3/t13-,14?,15?,16?,17-,18+,19-,20-/m0/s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	17.9	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
					More data for this Ligand-Target Pair