BDBM50114079 15-(2-Acetylamino-hexanoylamino)-9-benzyl-6-(3-guanidino-propyl)-12-(3H-imidazol-4-ylmethyl)-3-(1H-indol-3-ylmethyl)-2,5,8,11,14,17-hexaoxo-1,4,7,10,13,18hexaaza-cyclotetracosane-24-carboxylic acid amide::CHEMBL2370154::alpha-melanotropin-II(MT-II) peptide
SMILES: CCCC[C@H](NC(C)=O)C(=O)N[C@H]1CC(=O)NCCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O)C(N)=O
InChI Key: InChIKey=ILTSJNSAHXKVSQ-UHFFFAOYSA-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)) | BDBM50114079 (15-(2-Acetylamino-hexanoylamino)-9-benzyl-6-(3-gua...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona Curated by ChEMBL | Assay Description Binding affinity for human Melanocortin-4 receptor (hMC4R) | J Med Chem 45: 2644-50 (2002) BindingDB Entry DOI: 10.7270/Q2RB75B3 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 3 (Homo sapiens (Human)) | BDBM50114079 (15-(2-Acetylamino-hexanoylamino)-9-benzyl-6-(3-gua...) | UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 1.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona Curated by ChEMBL | Assay Description Binding affinity for human Melanocortin-3 receptor (hMC3R) expressed in HEK293 cells | J Med Chem 45: 2644-50 (2002) BindingDB Entry DOI: 10.7270/Q2RB75B3 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 5 (MC5R) (Homo sapiens (Human)) | BDBM50114079 (15-(2-Acetylamino-hexanoylamino)-9-benzyl-6-(3-gua...) | UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Arizona Curated by ChEMBL | Assay Description Binding affinity for human melanocortin 5 receptor (hMC5R) expressed in HEK293 cells | J Med Chem 45: 2644-50 (2002) BindingDB Entry DOI: 10.7270/Q2RB75B3 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 3 (Homo sapiens (Human)) | BDBM50114079 (15-(2-Acetylamino-hexanoylamino)-9-benzyl-6-(3-gua...) | UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | n/a | n/a | 1.90 | n/a | n/a | n/a | n/a |
University of Arizona Curated by ChEMBL | Assay Description Inhibition of human Melanocortin-3 receptor (hMC3R) expressed in HEK293 cells | J Med Chem 45: 2644-50 (2002) BindingDB Entry DOI: 10.7270/Q2RB75B3 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 4 (Homo sapiens (Human)) | BDBM50114079 (15-(2-Acetylamino-hexanoylamino)-9-benzyl-6-(3-gua...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | n/a | n/a | 2.90 | n/a | n/a | n/a | n/a |
University of Arizona Curated by ChEMBL | Assay Description Inhibition of binding to human Melanocortin-4 receptor (hMC4R) | J Med Chem 45: 2644-50 (2002) BindingDB Entry DOI: 10.7270/Q2RB75B3 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Melanocortin receptor 5 (MC5R) (Homo sapiens (Human)) | BDBM50114079 (15-(2-Acetylamino-hexanoylamino)-9-benzyl-6-(3-gua...) | UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | n/a | n/a | 3.30 | n/a | n/a | n/a | n/a |
University of Arizona Curated by ChEMBL | Assay Description Effective concentration against human melanocortin 5 receptor (hMC5R) in HEK293 cells | J Med Chem 45: 2644-50 (2002) BindingDB Entry DOI: 10.7270/Q2RB75B3 | |||||||||||
More data for this Ligand-Target Pair |