Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 3/20 | 0.38 |
| ▸ | CA1 | P00915 | 3/20 | 0.38 |
| ▸ | CA2 | P00918 | 3/20 | 0.38 |
| ▸ | CA7 | P43166 | 3/20 | 0.38 |
| ▸ | CA9 | Q16790 | 3/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | DPP4 | P27487 | 2/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL31405437 | 0.95 | CYP2C9 (0.47) | CYP2C9CYP2C19ALDH1A1LMNACA12 | |
| SCHEMBL31405429 | 0.93 | CYP2C9 (0.48) | CYP2C9CYP2C19ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL26632464 | 0.85 | CYP2C9 (0.41) | CYP2C9CYP2C19ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL23501684 | 0.81 | CYP2C9 (0.49) | CYP2C9CYP2C19ALDH1A1LMNACA12 | |
| SCHEMBL1092469 | 0.80 | CYP2C9 (0.51) | CYP2C9CYP2C19ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL23501601 | 0.79 | CYP2C9 (0.50) | CYP2C9CYP2C19ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL31405471 | 0.79 | CYP2C9 (0.44) | CYP2C9CYP2C19ALDH1A1LMNACA12 | |
| SCHEMBL16421764 | 0.79 | CYP2C9 (0.47) | CYP2C9CYP2C19ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL19266065 | 0.76 | CYP2C9 (0.44) | CYP2C9CYP2C19ALDH1A1SMN1; SMN2CA12 | |
| SCHEMBL3725916 | 0.75 | CYP2C9 (0.43) | CYP2C9CYP2C19ALDH1A1LMNASMN1; SMN2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023210599-A1 | COMPOUND SERVING AS DDR1 KINASE INHIBITOR, AND MEDICINE | 日本新薬株式会社 | 2023-11-02 | — | — | WO | disclosed |