null

SMILES: C[C@H]1C2Cc3cc4cc[nH]c4cc3[C@@]1(C)CCN2CC1CC1

InChI Key: InChIKey=FNKKDOCWGPFFMB-RIHNOLBDSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50124004   

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
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50124004 (13-cyclopropylmethyl-1,16-dimethyl-(1S,16R)-5,13-d...) Show SMILES C[C@H]1C2Cc3cc4cc[nH]c4cc3[C@@]1(C)CCN2CC1CC1 |r,TLB:11:12:1:17.16.15,18:17:1:4.12.3| Show InChI InChI=1S/C20H26N2/c1-13-19-10-16-9-15-5-7-21-18(15)11-17(16)20(13,2)6-8-22(19)12-14-3-4-14/h5,7,9,11,13-14,19,21H,3-4,6,8,10,12H2,1-2H3/t13-,19?,20-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Rensselaer Polytechnic Institute Curated by ChEMBL					Assay Description Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTPgammaS binding				Bioorg Med Chem Lett 19: 365-8 (2008) Article DOI: 10.1016/j.bmcl.2008.11.076 BindingDB Entry DOI: 10.7270/Q2M0458C
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig))	BDBM50124004 (13-cyclopropylmethyl-1,16-dimethyl-(1S,16R)-5,13-d...) Show SMILES C[C@H]1C2Cc3cc4cc[nH]c4cc3[C@@]1(C)CCN2CC1CC1 |r,TLB:11:12:1:17.16.15,18:17:1:4.12.3| Show InChI InChI=1S/C20H26N2/c1-13-19-10-16-9-15-5-7-21-18(15)11-17(16)20(13,2)6-8-22(19)12-14-3-4-14/h5,7,9,11,13-14,19,21H,3-4,6,8,10,12H2,1-2H3/t13-,19?,20-/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Rensselaer Polytechnic Institute Curated by ChEMBL					Assay Description Binding affinity towards Opioid receptor kappa 1 from guinea pig brain using [3H]U69,593 as radioligand				J Med Chem 46: 838-49 (2003) Article DOI: 10.1021/jm020429w BindingDB Entry DOI: 10.7270/Q2Z31Z09
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50124004 (13-cyclopropylmethyl-1,16-dimethyl-(1S,16R)-5,13-d...) Show SMILES C[C@H]1C2Cc3cc4cc[nH]c4cc3[C@@]1(C)CCN2CC1CC1 |r,TLB:11:12:1:17.16.15,18:17:1:4.12.3| Show InChI InChI=1S/C20H26N2/c1-13-19-10-16-9-15-5-7-21-18(15)11-17(16)20(13,2)6-8-22(19)12-14-3-4-14/h5,7,9,11,13-14,19,21H,3-4,6,8,10,12H2,1-2H3/t13-,19?,20-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	18	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Rensselaer Polytechnic Institute Curated by ChEMBL					Assay Description Agonist activity at human mu opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTPgammaS binding				Bioorg Med Chem Lett 19: 365-8 (2008) Article DOI: 10.1016/j.bmcl.2008.11.076 BindingDB Entry DOI: 10.7270/Q2M0458C
					More data for this Ligand-Target Pair
Mu-type opioid receptor (GUINEA PIG)	BDBM50124004 (13-cyclopropylmethyl-1,16-dimethyl-(1S,16R)-5,13-d...) Show SMILES C[C@H]1C2Cc3cc4cc[nH]c4cc3[C@@]1(C)CCN2CC1CC1 |r,TLB:11:12:1:17.16.15,18:17:1:4.12.3| Show InChI InChI=1S/C20H26N2/c1-13-19-10-16-9-15-5-7-21-18(15)11-17(16)20(13,2)6-8-22(19)12-14-3-4-14/h5,7,9,11,13-14,19,21H,3-4,6,8,10,12H2,1-2H3/t13-,19?,20-/m0/s1	UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	18	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Rensselaer Polytechnic Institute Curated by ChEMBL					Assay Description Binding affinity towards Opioid receptor mu 1 from guinea pig brain using [3H]DAMGO as radioligand				J Med Chem 46: 838-49 (2003) Article DOI: 10.1021/jm020429w BindingDB Entry DOI: 10.7270/Q2Z31Z09
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50124004 (13-cyclopropylmethyl-1,16-dimethyl-(1S,16R)-5,13-d...) Show SMILES C[C@H]1C2Cc3cc4cc[nH]c4cc3[C@@]1(C)CCN2CC1CC1 |r,TLB:11:12:1:17.16.15,18:17:1:4.12.3| Show InChI InChI=1S/C20H26N2/c1-13-19-10-16-9-15-5-7-21-18(15)11-17(16)20(13,2)6-8-22(19)12-14-3-4-14/h5,7,9,11,13-14,19,21H,3-4,6,8,10,12H2,1-2H3/t13-,19?,20-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	250	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Rensselaer Polytechnic Institute Curated by ChEMBL					Assay Description Binding affinity towards Opioid receptor delta 1 from guinea pig brain using [3H]naltrindole as radioligand				J Med Chem 46: 838-49 (2003) Article DOI: 10.1021/jm020429w BindingDB Entry DOI: 10.7270/Q2Z31Z09
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50124004 (13-cyclopropylmethyl-1,16-dimethyl-(1S,16R)-5,13-d...) Show SMILES C[C@H]1C2Cc3cc4cc[nH]c4cc3[C@@]1(C)CCN2CC1CC1 |r,TLB:11:12:1:17.16.15,18:17:1:4.12.3| Show InChI InChI=1S/C20H26N2/c1-13-19-10-16-9-15-5-7-21-18(15)11-17(16)20(13,2)6-8-22(19)12-14-3-4-14/h5,7,9,11,13-14,19,21H,3-4,6,8,10,12H2,1-2H3/t13-,19?,20-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	250	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Rensselaer Polytechnic Institute Curated by ChEMBL					Assay Description Displacement of [3H]Naltrindole from human delta opioid receptor expressed in CHO cells				Bioorg Med Chem Lett 19: 365-8 (2008) Article DOI: 10.1016/j.bmcl.2008.11.076 BindingDB Entry DOI: 10.7270/Q2M0458C
					More data for this Ligand-Target Pair