BDBM50152806 (R)-N-((R)-1-(4-(2-(aminomethyl)phenyl)piperazin-1-yl)-3-(4-chlorophenyl)-1-oxopropan-2-yl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide::1,2,3,4-Tetrahydro-isoquinoline-3-carboxylic acid [(R)-2-[4-(2-aminomethyl-phenyl)-piperazin-1-yl]-1-(4-chloro-benzyl)-2-oxo-ethyl]-amide::CHEMBL183434

SMILES: NCc1ccccc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H]1Cc2ccccc2CN1

InChI Key: InChIKey=MJWHBKTUULEGMJ-KAYWLYCHSA-N

Data: 7 KI  2 EC50

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 9 hits for monomerid = 50152806   

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
Melanocyte-stimulating hormone receptor (Homo sapiens (Human))	BDBM50152806 ((R)-N-((R)-1-(4-(2-(aminomethyl)phenyl)piperazin-1...) Show SMILES NCc1ccccc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H]1Cc2ccccc2CN1 |r| Show InChI InChI=1S/C30H34ClN5O2/c31-25-11-9-21(10-12-25)17-27(34-29(37)26-18-22-5-1-2-7-24(22)20-33-26)30(38)36-15-13-35(14-16-36)28-8-4-3-6-23(28)19-32/h1-12,26-27,33H,13-20,32H2,(H,34,37)/t26-,27-/m1/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	27	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc. Curated by ChEMBL					Assay Description Displacement of [125I]NDP-MSH from HEK293 cells expressing human melanocortin-1 receptor at 10 uM				Bioorg Med Chem Lett 14: 4417-23 (2004) Article DOI: 10.1016/j.bmcl.2004.06.059 BindingDB Entry DOI: 10.7270/Q2251HPH
					More data for this Ligand-Target Pair
Melanocortin receptor 3 (Homo sapiens (Human))	BDBM50152806 ((R)-N-((R)-1-(4-(2-(aminomethyl)phenyl)piperazin-1...) Show SMILES NCc1ccccc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H]1Cc2ccccc2CN1 |r| Show InChI InChI=1S/C30H34ClN5O2/c31-25-11-9-21(10-12-25)17-27(34-29(37)26-18-22-5-1-2-7-24(22)20-33-26)30(38)36-15-13-35(14-16-36)28-8-4-3-6-23(28)19-32/h1-12,26-27,33H,13-20,32H2,(H,34,37)/t26-,27-/m1/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	33	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc. Curated by ChEMBL					Assay Description Displacement of [125I]-NDP-MSH from HEK293 cells expressing human melanocortin-3 receptor at 10 uM				Bioorg Med Chem Lett 14: 4417-23 (2004) Article DOI: 10.1016/j.bmcl.2004.06.059 BindingDB Entry DOI: 10.7270/Q2251HPH
					More data for this Ligand-Target Pair
Melanocortin receptor 4 (Homo sapiens (Human))	BDBM50152806 ((R)-N-((R)-1-(4-(2-(aminomethyl)phenyl)piperazin-1...) Show SMILES NCc1ccccc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H]1Cc2ccccc2CN1 |r| Show InChI InChI=1S/C30H34ClN5O2/c31-25-11-9-21(10-12-25)17-27(34-29(37)26-18-22-5-1-2-7-24(22)20-33-26)30(38)36-15-13-35(14-16-36)28-8-4-3-6-23(28)19-32/h1-12,26-27,33H,13-20,32H2,(H,34,37)/t26-,27-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	380	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc. Curated by ChEMBL					Assay Description Binding affinity to human MC4 receptor				Bioorg Med Chem Lett 18: 4817-22 (2008) Article DOI: 10.1016/j.bmcl.2008.07.076 BindingDB Entry DOI: 10.7270/Q24T6J75
					More data for this Ligand-Target Pair
Melanocortin receptor 4 (Homo sapiens (Human))	BDBM50152806 ((R)-N-((R)-1-(4-(2-(aminomethyl)phenyl)piperazin-1...) Show SMILES NCc1ccccc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H]1Cc2ccccc2CN1 |r| Show InChI InChI=1S/C30H34ClN5O2/c31-25-11-9-21(10-12-25)17-27(34-29(37)26-18-22-5-1-2-7-24(22)20-33-26)30(38)36-15-13-35(14-16-36)28-8-4-3-6-23(28)19-32/h1-12,26-27,33H,13-20,32H2,(H,34,37)/t26-,27-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	380	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc. Curated by ChEMBL					Assay Description Displacement of [125I]NDP-MSH from HEK293 cells expressing human melanocortin-4 receptor				Bioorg Med Chem Lett 14: 4417-23 (2004) Article DOI: 10.1016/j.bmcl.2004.06.059 BindingDB Entry DOI: 10.7270/Q2251HPH
					More data for this Ligand-Target Pair
Melanocortin receptor 4 (Homo sapiens (Human))	BDBM50152806 ((R)-N-((R)-1-(4-(2-(aminomethyl)phenyl)piperazin-1...) Show SMILES NCc1ccccc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H]1Cc2ccccc2CN1 |r| Show InChI InChI=1S/C30H34ClN5O2/c31-25-11-9-21(10-12-25)17-27(34-29(37)26-18-22-5-1-2-7-24(22)20-33-26)30(38)36-15-13-35(14-16-36)28-8-4-3-6-23(28)19-32/h1-12,26-27,33H,13-20,32H2,(H,34,37)/t26-,27-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	380	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc. Curated by ChEMBL					Assay Description Agonist activity at human MC4 receptor expressed in HEK293 cells assessed as stimulation of cAMP production				J Med Chem 47: 6821-30 (2004) Article DOI: 10.1021/jm049278i BindingDB Entry DOI: 10.7270/Q2610ZSQ
					More data for this Ligand-Target Pair
Melanocortin receptor 5 (MC5R) (Homo sapiens (Human))	BDBM50152806 ((R)-N-((R)-1-(4-(2-(aminomethyl)phenyl)piperazin-1...) Show SMILES NCc1ccccc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H]1Cc2ccccc2CN1 |r| Show InChI InChI=1S/C30H34ClN5O2/c31-25-11-9-21(10-12-25)17-27(34-29(37)26-18-22-5-1-2-7-24(22)20-33-26)30(38)36-15-13-35(14-16-36)28-8-4-3-6-23(28)19-32/h1-12,26-27,33H,13-20,32H2,(H,34,37)/t26-,27-/m1/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc. Curated by ChEMBL					Assay Description Displacement of [125I]NDP-MSH from HEK293 cells expressing human melanocortin-5 receptor				Bioorg Med Chem Lett 14: 4417-23 (2004) Article DOI: 10.1016/j.bmcl.2004.06.059 BindingDB Entry DOI: 10.7270/Q2251HPH
					More data for this Ligand-Target Pair
Melanocortin receptor 5 (MC5R) (Homo sapiens (Human))	BDBM50152806 ((R)-N-((R)-1-(4-(2-(aminomethyl)phenyl)piperazin-1...) Show SMILES NCc1ccccc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H]1Cc2ccccc2CN1 |r| Show InChI InChI=1S/C30H34ClN5O2/c31-25-11-9-21(10-12-25)17-27(34-29(37)26-18-22-5-1-2-7-24(22)20-33-26)30(38)36-15-13-35(14-16-36)28-8-4-3-6-23(28)19-32/h1-12,26-27,33H,13-20,32H2,(H,34,37)/t26-,27-/m1/s1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc. Curated by ChEMBL					Assay Description Displacement of [125]NDP-MSH from human MC5 receptor expressed in HEK293 cells				J Med Chem 47: 6821-30 (2004) Article DOI: 10.1021/jm049278i BindingDB Entry DOI: 10.7270/Q2610ZSQ
					More data for this Ligand-Target Pair
Melanocortin receptor 4 (Homo sapiens (Human))	BDBM50152806 ((R)-N-((R)-1-(4-(2-(aminomethyl)phenyl)piperazin-1...) Show SMILES NCc1ccccc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H]1Cc2ccccc2CN1 |r| Show InChI InChI=1S/C30H34ClN5O2/c31-25-11-9-21(10-12-25)17-27(34-29(37)26-18-22-5-1-2-7-24(22)20-33-26)30(38)36-15-13-35(14-16-36)28-8-4-3-6-23(28)19-32/h1-12,26-27,33H,13-20,32H2,(H,34,37)/t26-,27-/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	274	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc. Curated by ChEMBL					Assay Description Effective concentration against cAMP release in CHO cells expressing human melanocortin-4 receptor				Bioorg Med Chem Lett 14: 4417-23 (2004) Article DOI: 10.1016/j.bmcl.2004.06.059 BindingDB Entry DOI: 10.7270/Q2251HPH
					More data for this Ligand-Target Pair
Melanocortin receptor 4 (Homo sapiens (Human))	BDBM50152806 ((R)-N-((R)-1-(4-(2-(aminomethyl)phenyl)piperazin-1...) Show SMILES NCc1ccccc1N1CCN(CC1)C(=O)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H]1Cc2ccccc2CN1 |r| Show InChI InChI=1S/C30H34ClN5O2/c31-25-11-9-21(10-12-25)17-27(34-29(37)26-18-22-5-1-2-7-24(22)20-33-26)30(38)36-15-13-35(14-16-36)28-8-4-3-6-23(28)19-32/h1-12,26-27,33H,13-20,32H2,(H,34,37)/t26-,27-/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	890	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc. Curated by ChEMBL					Assay Description Agonist activity at human MC4 receptor expressed in HEK293 cells assessed as stimulation of cAMP production				J Med Chem 47: 6821-30 (2004) Article DOI: 10.1021/jm049278i BindingDB Entry DOI: 10.7270/Q2610ZSQ
					More data for this Ligand-Target Pair