Reaction Details |
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Target | Oxytocin receptor |
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Ligand | BDBM50412927 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_515099 (CHEMBL1035607) |
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Ki | 316.23±n/a nM |
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Citation | Bellenie, BR; Barton, NP; Emmons, AJ; Heer, JP; Salvagno, C Discovery and optimization of highly ligand-efficient oxytocin receptor antagonists using structure-based drug design. Bioorg Med Chem Lett19:990-4 (2009) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Oxytocin receptor |
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Name: | Oxytocin receptor |
Synonyms: | OT-R | OXTR | OXYR_HUMAN | Oxytocin |
Type: | Enzyme Catalytic Domain |
Mol. Mass.: | 42793.26 |
Organism: | Homo sapiens (Human) |
Description: | Oxytocin OXTR HEK293::B2R9L7 |
Residue: | 389 |
Sequence: | MEGALAANWSAEAANASAAPPGAEGNRTAGPPRRNEALARVEVAVLCLILLLALSGNACV
LLALRTTRQKHSRLFFFMKHLSIADLVVAVFQVLPQLLWDITFRFYGPDLLCRLVKYLQV
VGMFASTYLLLLMSLDRCLAICQPLRSLRRRTDRLAVLATWLGCLVASAPQVHIFSLREV
ADGVFDCWAVFIQPWGPKAYITWITLAVYIVPVIVLAACYGLISFKIWQNLRLKTAAAAA
AEAPEGAAAGDGGRVALARVSSVKLISKAKIRTVKMTFIIVLAFIVCWTPFFFVQMWSVW
DANAPKEASAFIIVMLLASLNSCCNPWIYMLFTGHLFHELVQRFLCCSASYLKGRRLGET
SASKKSNSSSFVLSHRSSSQRSCSQPSTA
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BDBM50412927 |
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n/a |
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Name | BDBM50412927 |
Synonyms: | CHEMBL515447 |
Type | Small organic molecule |
Emp. Form. | C22H23F3N2O2 |
Mol. Mass. | 404.4254 |
SMILES | FC(F)(F)c1ccccc1-c1ccc(cn1)C(=O)N(CC1CC1)CC1CCCO1 |
Structure |
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