Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TUBB1 | Q9H4B7 | 5/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | CNR2 | P34972 | 1/20 | 0.50 |
| ▸ | TYR | P14679 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3628189 | 1.00 | TUBB1 (0.50) | TUBB1CYP3A4ATMCNR2TYR | |
| SCHEMBL10974635 | 0.87 | TUBB1 (0.61) | TUBB1ALDH1A1KDM4ELMNASMN1; SMN2 | |
| SCHEMBL10974637 | 0.87 | TUBB1 (0.61) | TUBB1ALDH1A1KDM4ELMNASMN1; SMN2 | |
| SCHEMBL12506745 | 0.79 | TUBB1 (0.49) | TUBB1CYP3A4ATMCNR2TYR | |
| SCHEMBL10695306 | 0.79 | CYP3A4 (0.46) | TUBB1CYP3A4ATMCNR2TYR | |
| SCHEMBL10624527 | 0.79 | TUBB1 (0.49) | TUBB1CYP3A4ATMCNR2TYR | |
| SCHEMBL13344899 | 0.79 | CNR2 (0.61) | TUBB1CYP3A4ATMCNR2TYR | |
| SCHEMBL22548434 | 0.79 | CNR2 (0.45) | TUBB1CYP3A4ATMCNR2TYR | |
| SCHEMBL16016282 | 0.79 | CNR2 (0.67) | TUBB1CYP3A4ATMCNR2TYR | |
| SCHEMBL10695308 | 0.79 | CYP3A4 (0.46) | TUBB1CYP3A4ATMCNR2TYR |
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 |
|---|---|---|---|---|---|---|---|
| US-9730931-B2 | Pyrimidine FGFR4 inhibitors | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2017-08-15 | — | — | US | disclosed |