null

SMILES: Clc1ccc(C[C@@H](NC(=O)[C@H]2Cc3ccccc3CN2)C(=O)N2CCC(CN3C(=O)OCC33CCC3)(CC2)C2CCCCC2)cc1

InChI Key: InChIKey=KPAXZSMXFNRRAR-ROJLCIKYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 50179132   

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
Melanocortin receptor 5 (Homo sapiens (Human))	BDBM50179132 ((R)-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic a...) Show SMILES Clc1ccc(C[C@@H](NC(=O)[C@H]2Cc3ccccc3CN2)C(=O)N2CCC(CN3C(=O)OCC33CCC3)(CC2)C2CCCCC2)cc1 Show InChI InChI=1S/C37H47ClN4O4/c38-30-13-11-26(12-14-30)21-32(40-33(43)31-22-27-7-4-5-8-28(27)23-39-31)34(44)41-19-17-36(18-20-41,29-9-2-1-3-10-29)24-42-35(45)46-25-37(42)15-6-16-37/h4-5,7-8,11-14,29,31-32,39H,1-3,6,9-10,15-25H2,(H,40,43)/t31-,32-/m1/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Activity against human MC5R by cAMP accumulation				Bioorg Med Chem Lett 16: 1130-3 (2006) Article DOI: 10.1016/j.bmcl.2005.11.095 BindingDB Entry DOI: 10.7270/Q2NG4Q5S
					More data for this Ligand-Target Pair
Melanocortin receptor 4 (Homo sapiens (Human))	BDBM50179132 ((R)-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic a...) Show SMILES Clc1ccc(C[C@@H](NC(=O)[C@H]2Cc3ccccc3CN2)C(=O)N2CCC(CN3C(=O)OCC33CCC3)(CC2)C2CCCCC2)cc1 Show InChI InChI=1S/C37H47ClN4O4/c38-30-13-11-26(12-14-30)21-32(40-33(43)31-22-27-7-4-5-8-28(27)23-39-31)34(44)41-19-17-36(18-20-41,29-9-2-1-3-10-29)24-42-35(45)46-25-37(42)15-6-16-37/h4-5,7-8,11-14,29,31-32,39H,1-3,6,9-10,15-25H2,(H,40,43)/t31-,32-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.90	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Displacement of [125I]NDP-alpha-MSH from human MC4R expressed in CHO cells				Bioorg Med Chem Lett 16: 1130-3 (2006) Article DOI: 10.1016/j.bmcl.2005.11.095 BindingDB Entry DOI: 10.7270/Q2NG4Q5S
					More data for this Ligand-Target Pair
Melanocortin receptor 3 (Homo sapiens (Human))	BDBM50179132 ((R)-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic a...) Show SMILES Clc1ccc(C[C@@H](NC(=O)[C@H]2Cc3ccccc3CN2)C(=O)N2CCC(CN3C(=O)OCC33CCC3)(CC2)C2CCCCC2)cc1 Show InChI InChI=1S/C37H47ClN4O4/c38-30-13-11-26(12-14-30)21-32(40-33(43)31-22-27-7-4-5-8-28(27)23-39-31)34(44)41-19-17-36(18-20-41,29-9-2-1-3-10-29)24-42-35(45)46-25-37(42)15-6-16-37/h4-5,7-8,11-14,29,31-32,39H,1-3,6,9-10,15-25H2,(H,40,43)/t31-,32-/m1/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Displacement of [125I]NDP-alpha-MSH from human MC3R expressed in CHO cells				Bioorg Med Chem Lett 16: 1130-3 (2006) Article DOI: 10.1016/j.bmcl.2005.11.095 BindingDB Entry DOI: 10.7270/Q2NG4Q5S
					More data for this Ligand-Target Pair
Melanocyte-stimulating hormone receptor (Homo sapiens (Human))	BDBM50179132 ((R)-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic a...) Show SMILES Clc1ccc(C[C@@H](NC(=O)[C@H]2Cc3ccccc3CN2)C(=O)N2CCC(CN3C(=O)OCC33CCC3)(CC2)C2CCCCC2)cc1 Show InChI InChI=1S/C37H47ClN4O4/c38-30-13-11-26(12-14-30)21-32(40-33(43)31-22-27-7-4-5-8-28(27)23-39-31)34(44)41-19-17-36(18-20-41,29-9-2-1-3-10-29)24-42-35(45)46-25-37(42)15-6-16-37/h4-5,7-8,11-14,29,31-32,39H,1-3,6,9-10,15-25H2,(H,40,43)/t31-,32-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Activity against human MC1BR by cAMP accumulation				Bioorg Med Chem Lett 16: 1130-3 (2006) Article DOI: 10.1016/j.bmcl.2005.11.095 BindingDB Entry DOI: 10.7270/Q2NG4Q5S
					More data for this Ligand-Target Pair
Melanocortin receptor 5 (Homo sapiens (Human))	BDBM50179132 ((R)-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic a...) Show SMILES Clc1ccc(C[C@@H](NC(=O)[C@H]2Cc3ccccc3CN2)C(=O)N2CCC(CN3C(=O)OCC33CCC3)(CC2)C2CCCCC2)cc1 Show InChI InChI=1S/C37H47ClN4O4/c38-30-13-11-26(12-14-30)21-32(40-33(43)31-22-27-7-4-5-8-28(27)23-39-31)34(44)41-19-17-36(18-20-41,29-9-2-1-3-10-29)24-42-35(45)46-25-37(42)15-6-16-37/h4-5,7-8,11-14,29,31-32,39H,1-3,6,9-10,15-25H2,(H,40,43)/t31-,32-/m1/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Displacement of [125I]NDP-alpha-MSH from human MC5R expressed in CHO cells				Bioorg Med Chem Lett 16: 1130-3 (2006) Article DOI: 10.1016/j.bmcl.2005.11.095 BindingDB Entry DOI: 10.7270/Q2NG4Q5S
					More data for this Ligand-Target Pair
Melanocortin receptor 4 (Homo sapiens (Human))	BDBM50179132 ((R)-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic a...) Show SMILES Clc1ccc(C[C@@H](NC(=O)[C@H]2Cc3ccccc3CN2)C(=O)N2CCC(CN3C(=O)OCC33CCC3)(CC2)C2CCCCC2)cc1 Show InChI InChI=1S/C37H47ClN4O4/c38-30-13-11-26(12-14-30)21-32(40-33(43)31-22-27-7-4-5-8-28(27)23-39-31)34(44)41-19-17-36(18-20-41,29-9-2-1-3-10-29)24-42-35(45)46-25-37(42)15-6-16-37/h4-5,7-8,11-14,29,31-32,39H,1-3,6,9-10,15-25H2,(H,40,43)/t31-,32-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	15	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Activity against human MC4R by cAMP accumulation				Bioorg Med Chem Lett 16: 1130-3 (2006) Article DOI: 10.1016/j.bmcl.2005.11.095 BindingDB Entry DOI: 10.7270/Q2NG4Q5S
					More data for this Ligand-Target Pair
Melanocyte-stimulating hormone receptor (Homo sapiens (Human))	BDBM50179132 ((R)-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic a...) Show SMILES Clc1ccc(C[C@@H](NC(=O)[C@H]2Cc3ccccc3CN2)C(=O)N2CCC(CN3C(=O)OCC33CCC3)(CC2)C2CCCCC2)cc1 Show InChI InChI=1S/C37H47ClN4O4/c38-30-13-11-26(12-14-30)21-32(40-33(43)31-22-27-7-4-5-8-28(27)23-39-31)34(44)41-19-17-36(18-20-41,29-9-2-1-3-10-29)24-42-35(45)46-25-37(42)15-6-16-37/h4-5,7-8,11-14,29,31-32,39H,1-3,6,9-10,15-25H2,(H,40,43)/t31-,32-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Displacement of [125I]NDP-alpha-MSH from human MC1BR expressed in CHO cells				Bioorg Med Chem Lett 16: 1130-3 (2006) Article DOI: 10.1016/j.bmcl.2005.11.095 BindingDB Entry DOI: 10.7270/Q2NG4Q5S
					More data for this Ligand-Target Pair