Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 3/20 | 0.62 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.54 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.54 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 8/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 8/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | CLK4 | Q9HAZ1 | 6/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL4631413 | 1.00 | CYP2A6 (0.62) | CYP2A6HSP90AA1HSP90AB1PTK2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL28197928 | 0.98 | CYP2A6 (0.60) | CYP2A6HSP90AA1HSP90AB1PTK2ALDH1A1 | |
| Pyrrole SCHEMBL28198557 | 0.91 | CYP2A6 (0.51) | CYP2A6HSP90AA1HSP90AB1PTK2ALDH1A1 | |
| SCHEMBL30462066 | 0.81 | HSP90AA1 (0.40) | CYP2A6HSP90AA1HSP90AB1PTK2ALDH1A1 | |
| SCHEMBL1828161 | 0.80 | ADORA2A (0.53) | HSP90AA1ALDH1A1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL27877200 | 0.78 | CYP2A6 (0.62) | CYP2A6HSP90AA1HSP90AB1PTK2ALDH1A1 | |
| SCHEMBL15972704 | 0.78 | CYP2A6 (0.62) | CYP2A6HSP90AA1HSP90AB1PTK2ALDH1A1 | |
| SCHEMBL10817963 | 0.78 | CYP2A6 (0.62) | CYP2A6ALDH1A1HSD17B10LMNAALOX15 | |
| SCHEMBL18905348 | 0.78 | CYP2A6 (0.62) | CYP2A6HSP90AA1HSP90AB1PTK2ALDH1A1 | |
| SCHEMBL15966607 | 0.78 | CYP2A6 (0.62) | CYP2A6ALDH1A1HSD17B10LMNAALOX15 |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-120114878-A | Sterilization defoamer for foam drainage and preparation method thereof | 成都欣明化工有限公司 | 2025-06-10 | — | — | CN | disclosed |
| CN-119371371-A | Compounds and compositions as PDGF receptor kinase inhibitors | 日本新药株式会社 | 2025-01-28 | — | — | CN | disclosed |
| CN-115315421-B | Compounds and compositions as PDGF receptor kinase inhibitors | 日本新药株式会社 | 2024-12-03 | — | — | CN | disclosed |
| EP-4444309-A1 | PYRIMIDINES AND METHODS OF THEIR USE | Kineta, Inc. (US) | 2024-10-16 | — | — | EP | disclosed |
| CN-116969923-B | Heteroaryl amino compounds, methods of preparation and use thereof | 北京鞍石生物科技股份有限公司 | 2024-07-30 | — | — | CN | disclosed |
| WO-2024152986-A1 | HETEROARYL AMINO COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF | 北京鞍石生物科技有限责任公司 | 2024-07-25 | — | — | WO | disclosed |
| CN-117940424-A | EGFR inhibitors | 缆图药品公司 | 2024-04-26 | — | — | CN | disclosed |
| CN-116969923-A | Heteroaryl amino compounds, methods of preparation and use thereof | 北京鞍石生物科技有限责任公司 | 2023-10-31 | — | — | CN | disclosed |
| WO-2023107603-A1 | PYRIMIDINES AND METHODS OF THEIR USE | Kineta, Inc. (US) | 2023-06-15 | — | — | WO | disclosed |
| WO-2022271630-A1 | EGFR INHIBITORS | BLUEPRINT MEDICINES CORPORATION (US) | 2022-12-29 | — | — | WO | disclosed |
| CN-115315421-A | Compounds and compositions as PDGF receptor kinase inhibitors | 日本新药株式会社 | 2022-11-08 | — | — | CN | disclosed |