BDBM50323159 CHEMBL1209321::N-(2-(4-((3S,4R)-1-tert-butyl-4-(2,4-difluorophenyl)pyrrolidine-3-carbonyl)piperazin-1-yl)-4-methylpentyl)-N-isopropyl acetamide::N-(2-(4-((3S,4R)-1-tert-butyl-4-(2,4-difluorophenyl)pyrrolidine-3-carbonyl)piperazin-1-yl)-4-methylpentyl)-N-isopropylacetamide
SMILES: CC(C)CC(CN(C(C)C)C(C)=O)N1CCN(CC1)C(=O)[C@@H]1CN(C[C@H]1c1ccc(F)cc1F)C(C)(C)C
InChI Key: InChIKey=NRXOSRAXRKFLQU-CUBVPSHMSA-N
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 4 (Homo sapiens (Human)) | BDBM50323159 (CHEMBL1209321 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 49 | 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 MC4 receptor expressed in CHO cells | Bioorg Med Chem Lett 20: 4483-6 (2010) Article DOI: 10.1016/j.bmcl.2010.06.038 BindingDB Entry DOI: 10.7270/Q2C829GJ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50323159 (CHEMBL1209321 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | n/a | 29 | n/a | n/a | n/a | n/a |
Merck Research Laboratories Curated by ChEMBL | Assay Description Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation | Bioorg Med Chem Lett 20: 4483-6 (2010) Article DOI: 10.1016/j.bmcl.2010.06.038 BindingDB Entry DOI: 10.7270/Q2C829GJ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 3 (Homo sapiens (Human)) | BDBM50323159 (CHEMBL1209321 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...) | UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 4.70E+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 MC3 receptor expressed in CHO cells | Bioorg Med Chem Lett 20: 4483-6 (2010) Article DOI: 10.1016/j.bmcl.2010.06.038 BindingDB Entry DOI: 10.7270/Q2C829GJ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 3 (Homo sapiens (Human)) | BDBM50323159 (CHEMBL1209321 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...) | UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | n/a | 880 | n/a | n/a | n/a | n/a |
Merck Research Laboratories Curated by ChEMBL | Assay Description Agonist activity at human MC3 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation | Bioorg Med Chem Lett 20: 4483-6 (2010) Article DOI: 10.1016/j.bmcl.2010.06.038 BindingDB Entry DOI: 10.7270/Q2C829GJ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 5 (MC5R) (Homo sapiens (Human)) | BDBM50323159 (CHEMBL1209321 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...) | UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 1.10E+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 MC5 receptor expressed in CHO cells | Bioorg Med Chem Lett 20: 4483-6 (2010) Article DOI: 10.1016/j.bmcl.2010.06.038 BindingDB Entry DOI: 10.7270/Q2C829GJ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 5 (MC5R) (Homo sapiens (Human)) | BDBM50323159 (CHEMBL1209321 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...) | UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | n/a | >5.00E+3 | n/a | n/a | n/a | n/a |
Merck Research Laboratories Curated by ChEMBL | Assay Description Agonist activity at human MC5 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation | Bioorg Med Chem Lett 20: 4483-6 (2010) Article DOI: 10.1016/j.bmcl.2010.06.038 BindingDB Entry DOI: 10.7270/Q2C829GJ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50323159 (CHEMBL1209321 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 49 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories Curated by ChEMBL | Assay Description Agonist activity at human MC4 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation | Bioorg Med Chem Lett 20: 4483-6 (2010) Article DOI: 10.1016/j.bmcl.2010.06.038 BindingDB Entry DOI: 10.7270/Q2C829GJ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocyte-stimulating hormone receptor (Homo sapiens (Human)) | BDBM50323159 (CHEMBL1209321 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...) | PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | n/a | 560 | n/a | n/a | n/a | n/a |
Merck Research Laboratories Curated by ChEMBL | Assay Description Agonist activity at human MC1 receptor expressed in CHO cells assessed as increase of alpha-MSH-induced cAMP accumulation | Bioorg Med Chem Lett 20: 4483-6 (2010) Article DOI: 10.1016/j.bmcl.2010.06.038 BindingDB Entry DOI: 10.7270/Q2C829GJ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocyte-stimulating hormone receptor (Homo sapiens (Human)) | BDBM50323159 (CHEMBL1209321 | N-(2-(4-((3S,4R)-1-tert-butyl-4-(2...) | PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 3.60E+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 MC1 receptor expressed in CHO cells | Bioorg Med Chem Lett 20: 4483-6 (2010) Article DOI: 10.1016/j.bmcl.2010.06.038 BindingDB Entry DOI: 10.7270/Q2C829GJ | |||||||||||
More data for this Ligand-Target Pair |