BDBM50124773 (S)-2-{(S)-3-(4-Bromo-phenyl)-2-[(S)-2-butyrylamino-3-(3H-imidazol-4-yl)-propionylamino]-propionylamino}-5-guanidino-pentanoic acid [(S)-1-(carbamoylmethyl-carbamoyl)-2-(1H-indol-3-yl)-ethyl]-amide::CHEMBL158808
SMILES: CCCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(N)=O
InChI Key: InChIKey=DEKJJIFFJPAHRM-ORYMTKCHSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Melanocyte-stimulating hormone receptor (Homo sapiens (Human)) | BDBM50124773 ((S)-2-{(S)-3-(4-Bromo-phenyl)-2-[(S)-2-butyrylamin...) | PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | n/a | n/a | 54 | n/a | n/a | n/a | n/a |
Roche Research Center Curated by ChEMBL | Assay Description Effective concentration against hMC1R using HEK293 cells was determined by measuring the cAMP accumulation | Bioorg Med Chem Lett 13: 649-52 (2003) BindingDB Entry DOI: 10.7270/Q2V69J0G | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50124773 ((S)-2-{(S)-3-(4-Bromo-phenyl)-2-[(S)-2-butyrylamin...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | n/a | n/a | 13 | n/a | n/a | n/a | n/a |
Roche Research Center Curated by ChEMBL | Assay Description Inhibitory concentration of compound was determined against hMC1R through displacement of NDP-MSH radioligand using HEK293 cells | Bioorg Med Chem Lett 13: 649-52 (2003) BindingDB Entry DOI: 10.7270/Q2V69J0G | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocyte-stimulating hormone receptor (Homo sapiens (Human)) | BDBM50124773 ((S)-2-{(S)-3-(4-Bromo-phenyl)-2-[(S)-2-butyrylamin...) | PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 300 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center Curated by ChEMBL | Assay Description Inhibitory concentration of compound was determined against hMC4R through displacement of NDP-MSH radioligand using HEK293 cells | Bioorg Med Chem Lett 13: 649-52 (2003) BindingDB Entry DOI: 10.7270/Q2V69J0G | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50124773 ((S)-2-{(S)-3-(4-Bromo-phenyl)-2-[(S)-2-butyrylamin...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 22 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Research Center Curated by ChEMBL | Assay Description Inhibitory concentration of compound was determined against hMC4R through displacement of NDP-MSH radioligand using HEK293 cells | Bioorg Med Chem Lett 13: 649-52 (2003) BindingDB Entry DOI: 10.7270/Q2V69J0G | |||||||||||
More data for this Ligand-Target Pair |