Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL258568 | 0.82 | ALDH1A1 (0.44) | ESR2MCL1TP53TDP1ALDH1A1 | |
| SCHEMBL158243 | 0.75 | KDM4E (0.31) | ALDH1A1 | |
| SCHEMBL29434185 | 0.75 | KDM4E (0.31) | ALDH1A1 | |
| SCHEMBL8758668 | 0.74 | ESR2 (0.53) | ESR2TP53TDP1ALDH1A1TSHR | |
| Naphthalene SCHEMBL1712201 | 0.74 | CYP2A6 (0.41) | TDP1ALDH1A1TSHRCYP1A2 | |
| SCHEMBL7569813 | 0.72 | ALDH1A1 (0.44) | MCL1TP53TDP1ALDH1A1TSHR | |
| SCHEMBL11019624 | 0.71 | ALDH1A1 (0.40) | MCL1TDP1ALDH1A1TSHR | |
| SCHEMBL31432621 | 0.70 | ALDH1A1 (0.37) | ALDH1A1TSHR | |
| SCHEMBL8848267 | 0.70 | ALDH1A1 (0.37) | ALDH1A1TSHR | |
| SCHEMBL9127978 | 0.70 | BACE1 (0.43) | TP53TDP1ALDH1A1TSHR |
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-5430086-A | Rubber composition for tire treads | SUMITOMO RUBBER INDUSTRIES (JP) | 1995-07-04 | — | — | US | disclosed |