Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 2/20 | 0.38 |
| ▸ | CES1 | P23141 | 2/20 | 0.38 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.36 |
| ▸ | SLC2A4 | P14672 | 1/20 | 0.36 |
| ▸ | GCK | P35557 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.34 |
| ▸ | STING1 | Q86WV6 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TTR | P02766 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28440932 | 0.81 | KDM4E (0.42) | KMT2AHTTCES2CES1SLC2A1 | |
| SCHEMBL27426772 | 0.79 | KMT2A (0.44) | KMT2AMEN1CES2CES1SLC2A1 | |
| SCHEMBL27352499 | 0.78 | KMT2A (0.42) | KMT2AMEN1CES2CES1GAA | |
| SCHEMBL23042976 | 0.77 | GCK (0.47) | KMT2AHTTGCKALDH1A1GAA | |
| SCHEMBL28360716 | 0.77 | ALDH1A1 (0.41) | KMT2AMEN1CES2CES1SLC2A1 | |
| SCHEMBL8830200 | 0.77 | ACHE (0.40) | KMT2AHTTCES2CES1SLC2A1 | |
| SCHEMBL27513456 | 0.76 | KMT2A (0.38) | KMT2AMEN1CES2CES1SLC2A1 | |
| SCHEMBL28748508 | 0.75 | SCN5A (0.40) | KMT2AMEN1 | |
| SCHEMBL28332418 | 0.75 | ALDH1A1 (0.42) | KMT2AMEN1CES2CES1MAOB | |
| SCHEMBL27876194 | 0.75 | ALDH1A1 (0.53) | KMT2AMEN1CES2CES1SLC2A1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114615981-B | KRAS G12D inhibitors | 米拉蒂治疗股份有限公司 | 2024-04-12 | — | — | CN | disclosed |
| CN-114615981-A | KRAS G12D inhibitors | 米拉蒂治疗股份有限公司 | 2022-06-10 | — | — | CN | disclosed |
| CN-114437074-A | Compound, pharmaceutical composition containing compound and application of compound | 北京伯汇生物技术有限公司 | 2022-05-06 | — | — | CN | disclosed |
| CN-108368053-A | Substituted benzazepine derivatives as antibacterial compounds | 葛兰素史密斯克莱知识产权发展有限公司 | 2018-08-03 | — | — | CN | disclosed |
| CN-105121427-B | Pyridine radicals and condensed pyridine base triazolone derivative | 武田药品工业株式会社 | 2018-04-10 | — | — | CN | disclosed |
| CN-106488910-A | Inhibitors of kras g12c | 亚瑞克西斯制药公司 | 2017-03-08 | — | — | CN | disclosed |
| CN-105121427-A | Pyridinyl and fused pyridinyl triazolone derivatives | TAKEDA PHARMACEUTICAL | 2015-12-02 | — | — | CN | disclosed |