Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 3/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | PI4KA | P42356 | 1/20 | 0.33 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20342351 | 0.89 | CYP1A2 (0.44) | CYP2A6TDP1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL755299 | 0.89 | PIK3CA (0.41) | ALDH1A1HPGDSMN1; SMN2CYP1A2HSD17B10 | |
| SCHEMBL753442 | 0.87 | CYP2A6 (0.44) | CYP2A6TDP1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL17523405 | 0.87 | ALDH1A1 (0.41) | ALDH1A1HPGDSMN1; SMN2RAB9AMAPT | |
| SCHEMBL21335451 | 0.86 | ROCK1 (0.39) | CYP2A6TDP1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL17356230 | 0.85 | ALDH1A1 (0.42) | TDP1ALDH1A1HPGDSMN1; SMN2HSD17B10 | |
| SCHEMBL18267852 | 0.85 | ESR1 (0.40) | TDP1ALDH1A1HPGDSMN1; SMN2RAB9A | |
| SCHEMBL17356235 | 0.84 | CYP2A6 (0.45) | CYP2A6TDP1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL753421 | 0.82 | PGR (0.39) | ALDH1A1HPGDSMN1; SMN2CYP3A4HSD17B10 | |
| SCHEMBL14134052 | 0.82 | CYP2A6 (0.48) | CYP2A6TDP1ALDH1A1HPGDSMN1; 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 |
|---|---|---|---|---|---|---|---|
| US-8138355-B2 | Heteroacene derivative, tetrahaloterphenyl derivative, and processes for producing the same | TOSOH CORPORATION (JP) | 2012-03-20 | — | — | US | disclosed |