BDBM50225589 (4-(1-((3-fluoro-4-methoxybenzylamino)methyl)cyclohexyl)piperazin-1-yl)((3R,4S)-4-(4-chlorophenyl)-1-isopropylpyrrolidin-3-yl)methanone::CHEMBL398929
SMILES: COc1ccc(CNCC2(CCCCC2)N2CCN(CC2)C(=O)[C@H]2CN(C[C@@H]2c2ccc(Cl)cc2)C(C)C)cc1F
InChI Key: InChIKey=UQIQXCRYYCAMIP-WDYNHAJCSA-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)) | BDBM50225589 ((4-(1-((3-fluoro-4-methoxybenzylamino)methyl)cyclo...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 0.5 | 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 [12]NDPMSH from human MC4R expressed in HEK293 cells | Bioorg Med Chem Lett 17: 6825-31 (2007) Article DOI: 10.1016/j.bmcl.2007.10.032 BindingDB Entry DOI: 10.7270/Q2862G5Z | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Mus musculus) | BDBM50225589 ((4-(1-((3-fluoro-4-methoxybenzylamino)methyl)cyclo...) | PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 0.600 | 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 mouse MC4R | Bioorg Med Chem Lett 17: 6825-31 (2007) Article DOI: 10.1016/j.bmcl.2007.10.032 BindingDB Entry DOI: 10.7270/Q2862G5Z | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50225589 ((4-(1-((3-fluoro-4-methoxybenzylamino)methyl)cyclo...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 540 | 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 MC5R | Bioorg Med Chem Lett 17: 6825-31 (2007) Article DOI: 10.1016/j.bmcl.2007.10.032 BindingDB Entry DOI: 10.7270/Q2862G5Z | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 3 (Homo sapiens (Human)) | BDBM50225589 ((4-(1-((3-fluoro-4-methoxybenzylamino)methyl)cyclo...) | UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 760 | 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 MC3R | Bioorg Med Chem Lett 17: 6825-31 (2007) Article DOI: 10.1016/j.bmcl.2007.10.032 BindingDB Entry DOI: 10.7270/Q2862G5Z | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocyte-stimulating hormone receptor (Homo sapiens (Human)) | BDBM50225589 ((4-(1-((3-fluoro-4-methoxybenzylamino)methyl)cyclo...) | PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 3.90E+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 Binding affinity to MC1R | Bioorg Med Chem Lett 17: 6825-31 (2007) Article DOI: 10.1016/j.bmcl.2007.10.032 BindingDB Entry DOI: 10.7270/Q2862G5Z | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50225589 ((4-(1-((3-fluoro-4-methoxybenzylamino)methyl)cyclo...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 48 | n/a | n/a | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc. Curated by ChEMBL | Assay Description Antagonist activity at MC4R assessed as inhibition of alphaMSH-stimulated cAMP release | Bioorg Med Chem Lett 17: 6825-31 (2007) Article DOI: 10.1016/j.bmcl.2007.10.032 BindingDB Entry DOI: 10.7270/Q2862G5Z | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50225589 ((4-(1-((3-fluoro-4-methoxybenzylamino)methyl)cyclo...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | n/a | 170 | n/a | n/a | n/a | n/a |
Neurocrine Biosciences Inc. Curated by ChEMBL | Assay Description Agonist activity at MC4R assessed as stimulation of cAMP release | Bioorg Med Chem Lett 17: 6825-31 (2007) Article DOI: 10.1016/j.bmcl.2007.10.032 BindingDB Entry DOI: 10.7270/Q2862G5Z | |||||||||||
More data for this Ligand-Target Pair |