| Reaction Details |
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 | Report a problem with these data |
| Target | POU domain, class 2, transcription factor 1 |
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| Ligand | BDBM50228403 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_1491731 (CHEMBL3536923) |
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| IC50 | 45000±n/a nM |
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| Citation |  Ishiguro, N; Shimizu, H; Kishimoto, W; Ebner, T; Schaefer, O Evaluation and prediction of potential drug-drug interactions of linagliptin using in vitro cell culture methods. Drug Metab Dispos41:149-58 (2012) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| POU domain, class 2, transcription factor 1 |
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| Name: | POU domain, class 2, transcription factor 1 |
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| Synonyms: | NF-A1 | OCT1 | OCT1 | OTF-1 | OTF1 | Oct-1 | Octamer-binding protein 1 | Octamer-binding transcription factor 1 | PO2F1_HUMAN | POU domain, class 2, transcription factor 1 | POU2F1 |
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| Type: | PROTEIN |
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| Mol. Mass.: | 76471.70 |
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| Organism: | Homo sapiens (Human) |
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| Description: | ChEMBL_109690 |
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| Residue: | 743 |
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| Sequence: | MNNPSETSKPSMESGDGNTGTQTNGLDFQKQPVPVGGAISTAQAQAFLGHLHQVQLAGTS
LQAAAQSLNVQSKSNEESGDSQQPSQPSQQPSVQAAIPQTQLMLAGGQITGLTLTPAQQQ
LLLQQAQAQAQLLAAAVQQHSASQQHSAAGATISASAATPMTQIPLSQPIQIAQDLQQLQ
QLQQQNLNLQQFVLVHPTTNLQPAQFIISQTPQGQQGLLQAQNLLTQLPQQSQANLLQSQ
PSITLTSQPATPTRTIAATPIQTLPQSQSTPKRIDTPSLEEPSDLEELEQFAKTFKQRRI
KLGFTQGDVGLAMGKLYGNDFSQTTISRFEALNLSFKNMCKLKPLLEKWLNDAENLSSDS
SLSSPSALNSPGIEGLSRRRKKRTSIETNIRVALEKSFLENQKPTSEEITMIADQLNMEK
EVIRVWFCNRRQKEKRINPPSSGGTSSSPIKAIFPSPTSLVATTPSLVTSSAATTLTVSP
VLPLTSAAVTNLSVTGTSDTTSNNTATVISTAPPASSAVTSPSLSPSPSASASTSEASSA
SETSTTQTTSTPLSSPLGTSQVMVTASGLQTAAAAALQGAAQLPANASLAAMAAAAGLNP
SLMAPSQFAAGGALLSLNPGTLSGALSPALMSNSTLATIQALASGGSLPITSLDATGNLV
FANAGGAPNIVTAPLFLNPQNLSLLTSNPVSLVSAAAASAGNSAPVASLHATSTSAESIQ
NSLFTVASASGAASTTTTASKAQ
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| BDBM50228403 |
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| n/a |
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| Name | BDBM50228403 |
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| Synonyms: | (R)-8-(3-aminopiperidin-1-yl)-7-(but-2-ynyl)-3-methyl-1-((4-methylquinazolin-2-yl)methyl)-1H-purine-2,6(3H,7H)-dione | 8-[(3R)-3-Aminopiperidin-1-yl]-7-but-2-yn-1-yl-3-methyl-1-[(4-methylquinazolin-2-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione | CHEMBL237500 | LINAGLIPTIN | US10202383, Example 2(142) | US10358449, Linagliptin | US9255098, Linagliptin | US9321791, 2(142) | US9556175, 2(142) |
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| Type | Small organic molecule |
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| Emp. Form. | C25H28N8O2 |
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| Mol. Mass. | 472.5422 |
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| SMILES | CC#CCn1c(nc2n(C)c(=O)n(Cc3nc(C)c4ccccc4n3)c(=O)c12)N1CCC[C@@H](N)C1 |
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| Structure | 
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