BDBM102397 US8536192, I-30

SMILES: Oc1ccc2C[C@H]3N(CC4CC4)CC[C@@]45[C@@H](Oc1c24)C(=O)C(C[C@@]35O)C(=O)NCCOc1ccccc1

InChI Key: InChIKey=VWXPCRAFSSKJNE-XWNPEIPWSA-N

Data: 1 KI

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 = 102397   

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
Opioid receptors; mu & delta (Rattus norvegicus (rat))	BDBM102397 (US8536192, I-30) Show SMILES Oc1ccc2C[C@H]3N(CC4CC4)CC[C@@]45[C@@H](Oc1c24)C(=O)C(C[C@@]35O)C(=O)NCCOc1ccccc1 |r,TLB:22:23:4.18.5:7.12.13,THB:24:23:4.18.5:7.12.13| Show InChI InChI=1S/C29H32N2O6/c32-21-9-8-18-14-22-29(35)15-20(27(34)30-11-13-36-19-4-2-1-3-5-19)24(33)26-28(29,23(18)25(21)37-26)10-12-31(22)16-17-6-7-17/h1-5,8-9,17,20,22,26,32,35H,6-7,10-16H2,(H,30,34)/t20?,22-,26+,28+,29-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	5.34	-11.3	n/a	n/a	n/a	n/a	n/a	n/a	25
Shionogi & Co. Ltd. US Patent					Assay Description Binding assay of opioid receptor.				US Patent US8536192 (2013) BindingDB Entry DOI: 10.7270/Q24M935Z
					More data for this Ligand-Target Pair