BDBM50494232 CHEMBL3086466

SMILES: Cl.[H][C@@]12CCC[C@](C1)([C@H](C)CN2CCCc1ccccc1)c1cccc(O)c1

InChI Key: InChIKey=OQLWTYUBRVBKAG-JJXQBOQPSA-N

Data: 3 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 3 hits for monomerid = 50494232   

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
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50494232 (CHEMBL3086466) Show SMILES Cl.[H][C@@]12CCC[C@](C1)([C@H](C)CN2CCCc1ccccc1)c1cccc(O)c1 |r| Show InChI InChI=1S/C24H31NO.ClH/c1-19-18-25(15-7-10-20-8-3-2-4-9-20)22-12-6-14-24(19,17-22)21-11-5-13-23(26)16-21;/h2-5,8-9,11,13,16,19,22,26H,6-7,10,12,14-15,17-18H2,1H3;1H/t19-,22-,24+;/m1./s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute Curated by ChEMBL					Assay Description Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHO cells				J Med Chem 56: 8826-33 (2013) Article DOI: 10.1021/jm401250s BindingDB Entry DOI: 10.7270/Q2V127SP
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50494232 (CHEMBL3086466) Show SMILES Cl.[H][C@@]12CCC[C@](C1)([C@H](C)CN2CCCc1ccccc1)c1cccc(O)c1 |r| Show InChI InChI=1S/C24H31NO.ClH/c1-19-18-25(15-7-10-20-8-3-2-4-9-20)22-12-6-14-24(19,17-22)21-11-5-13-23(26)16-21;/h2-5,8-9,11,13,16,19,22,26H,6-7,10,12,14-15,17-18H2,1H3;1H/t19-,22-,24+;/m1./s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	7.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute Curated by ChEMBL					Assay Description Displacement of [3H]U-69593 from human kappa opioid receptor expressed in CHO cells				J Med Chem 56: 8826-33 (2013) Article DOI: 10.1021/jm401250s BindingDB Entry DOI: 10.7270/Q2V127SP
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50494232 (CHEMBL3086466) Show SMILES Cl.[H][C@@]12CCC[C@](C1)([C@H](C)CN2CCCc1ccccc1)c1cccc(O)c1 |r| Show InChI InChI=1S/C24H31NO.ClH/c1-19-18-25(15-7-10-20-8-3-2-4-9-20)22-12-6-14-24(19,17-22)21-11-5-13-23(26)16-21;/h2-5,8-9,11,13,16,19,22,26H,6-7,10,12,14-15,17-18H2,1H3;1H/t19-,22-,24+;/m1./s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	161	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute Curated by ChEMBL					Assay Description Displacement of [3H]DADLE from human delta opioid receptor expressed in CHO cells				J Med Chem 56: 8826-33 (2013) Article DOI: 10.1021/jm401250s BindingDB Entry DOI: 10.7270/Q2V127SP
					More data for this Ligand-Target Pair