BDBM50076500 24-ethyl-19-methoxy-4,24-diazahexacyclo[12.7.3.01,13.03,11.05,10.016,21]tetracosa-3(11),5(10),6,8,16,18,20-heptaene-13,20-diol::CHEMBL297433

SMILES: CCN1CC[C@]23Cc4[nH]c5ccccc5c4C[C@@]2(O)[C@H]1Cc1ccc(OC)c(O)c31

InChI Key: InChIKey=CQFZVTKUQVHADR-NQHRYMMQSA-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 = 50076500   

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))	BDBM50076500 (24-ethyl-19-methoxy-4,24-diazahexacyclo[12.7.3.01,...) Show SMILES CCN1CC[C@]23Cc4[nH]c5ccccc5c4C[C@@]2(O)[C@H]1Cc1ccc(OC)c(O)c31 Show InChI InChI=1S/C25H28N2O3/c1-3-27-11-10-24-14-19-17(16-6-4-5-7-18(16)26-19)13-25(24,29)21(27)12-15-8-9-20(30-2)23(28)22(15)24/h4-9,21,26,28-29H,3,10-14H2,1-2H3/t21-,24-,25-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	684	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes Curated by ChEMBL					Assay Description Binding affinity towards Opioid receptor delta 1 by the displacement of [3H]DADLE radioligand in rat brain membranes				J Med Chem 42: 1673-9 (1999) Article DOI: 10.1021/jm9807003 BindingDB Entry DOI: 10.7270/Q24M957P
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50076500 (24-ethyl-19-methoxy-4,24-diazahexacyclo[12.7.3.01,...) Show SMILES CCN1CC[C@]23Cc4[nH]c5ccccc5c4C[C@@]2(O)[C@H]1Cc1ccc(OC)c(O)c31 Show InChI InChI=1S/C25H28N2O3/c1-3-27-11-10-24-14-19-17(16-6-4-5-7-18(16)26-19)13-25(24,29)21(27)12-15-8-9-20(30-2)23(28)22(15)24/h4-9,21,26,28-29H,3,10-14H2,1-2H3/t21-,24-,25-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	797	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes Curated by ChEMBL					Assay Description Binding affinity towards Opioid receptor mu 1 by the displacement of [3H]DAMGO radioligand in rat brain membranes				J Med Chem 42: 1673-9 (1999) Article DOI: 10.1021/jm9807003 BindingDB Entry DOI: 10.7270/Q24M957P
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig))	BDBM50076500 (24-ethyl-19-methoxy-4,24-diazahexacyclo[12.7.3.01,...) Show SMILES CCN1CC[C@]23Cc4[nH]c5ccccc5c4C[C@@]2(O)[C@H]1Cc1ccc(OC)c(O)c31 Show InChI InChI=1S/C25H28N2O3/c1-3-27-11-10-24-14-19-17(16-6-4-5-7-18(16)26-19)13-25(24,29)21(27)12-15-8-9-20(30-2)23(28)22(15)24/h4-9,21,26,28-29H,3,10-14H2,1-2H3/t21-,24-,25-/m1/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>5.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes Curated by ChEMBL					Assay Description Ability to displace [3H]U-69593 radioligand from Opioid receptor kappa 1				J Med Chem 42: 1673-9 (1999) Article DOI: 10.1021/jm9807003 BindingDB Entry DOI: 10.7270/Q24M957P
					More data for this Ligand-Target Pair