Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 5/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | EEF2K | O00418 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | SCD | O00767 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | IKBKB | O14920 | 1/20 | 0.34 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.34 |
| ▸ | DAPK3 | O43293 | 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 | |
|---|---|---|---|---|
| SCHEMBL6761817 | 0.84 | ALDH1A1 (0.52) | KDM4ENPC1ALDH1A1HPGDTSHR | |
| SCHEMBL23421075 | 0.80 | ATM (0.37) | BTKGSK3BLMNACYP1A2CYP3A4 | |
| SCHEMBL21858616 | 0.77 | ALDH1A1 (0.49) | BTKKDM4ENPC1ALDH1A1HPGD | |
| SCHEMBL18114152 | 0.77 | ALDH1A1 (0.49) | BTKLMNAKDM4ENPC1ALDH1A1 | |
| SCHEMBL2286405 | 0.76 | TSHR (0.41) | BTKLMNACYP1A2MAPTNPC1 | |
| SCHEMBL4762312 | 0.76 | ALDH1A1 (0.47) | BTKLMNAKDM4ENPC1ALDH1A1 | |
| SCHEMBL21066362 | 0.75 | RAB9A (0.35) | BTKROCK2NPC1 | |
| SCHEMBL20654288 | 0.74 | ROCK2 (0.50) | BTKGSK3BROCK2ALDH1A1IKBKB | |
| SCHEMBL19936549 | 0.74 | ALDH1A1 (0.54) | LMNAMAPTKDM4ENPC1HTT | |
| SCHEMBL21858733 | 0.73 | PIK3CD (0.52) | MAPTKDM4ENPC1ALDH1A1HPGD |
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 |