Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | EDNRB | P24530 | 1/20 | 0.33 |
| ▸ | EDNRA | P25101 | 1/20 | 0.33 |
| ▸ | TYMS | P04818 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL72824 | 0.89 | ALOX15 (0.40) | ALOX15TDP1TYMS | |
| SCHEMBL108619 | 0.84 | ALOX15 (0.44) | ALOX15TDP1TYMS | |
| SCHEMBL2815250 | 0.80 | ALOX15 (0.38) | ALOX15TDP1TYMS | |
| Trifluoromethylbenzene SCHEMBL27881692 | 0.77 | ALDH1A1 (0.40) | ALOX15TDP1KMT2AMEN1ALDH1A1 | |
| Phthalic Anhydride SCHEMBL8372249 | 0.72 | TDP1 (0.70) | ALOX15TDP1KMT2AMEN1POLB | |
| SCHEMBL28740199 | 0.72 | CA12 (0.44) | ALOX15TDP1KMT2AMEN1POLB | |
| SCHEMBL2809225 | 0.71 | ALOX15 (0.32) | ALOX15TDP1TYMS | |
| SCHEMBL30499372 | 0.71 | ALOX15 (0.50) | ALOX15TDP1KMT2AMEN1SMN1; SMN2 | |
| SCHEMBL29067257 | 0.71 | ALOX15 (0.50) | ALOX15TDP1KMT2AMEN1SMN1; SMN2 | |
| SCHEMBL12814518 | 0.70 | TDP1 (0.48) | ALOX15TDP1KDM4EALDH1A1HPGD |
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-2001058909-A1 | PHENYLETHYNYL-CONTAINING IMIDE SILANES | THE GOVERNMENT OF THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (NASA) (US) | 2001-08-16 | — | — | WO | disclosed |