Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.59 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.56 |
| ▸ | MAPT | P10636 | 4/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | FBP1 | P09467 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.55 |
| ▸ | LMNA | P02545 | 5/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.55 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 4/20 | 0.50 |
| ▸ | EGFR | P00533 | 1/20 | 0.50 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | BLM | P54132 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL5805642 | 1.00 | CYP1A2 (0.59) | CYP1A2CYP3A4HIF1AALDH1A1MAPT | |
| SCHEMBL4943479 | 0.92 | CYP1A2 (0.63) | CYP1A2CYP3A4HIF1AALDH1A1MAPT | |
| SCHEMBL29894113 | 0.92 | CYP1A2 (0.63) | CYP1A2CYP3A4HIF1AALDH1A1MAPT | |
| SCHEMBL5805643 | 0.79 | CYP1A2 (0.59) | CYP1A2CYP3A4HIF1AALDH1A1MAPT | |
| SCHEMBL9364797 | 0.78 | KDM4E (0.67) | CYP1A2CYP3A4HIF1AALDH1A1MAPT | |
| SCHEMBL17397039 | 0.78 | KDM4E (0.67) | CYP1A2CYP3A4HIF1AALDH1A1MAPT | |
| SCHEMBL17397040 | 0.78 | KDM4E (0.67) | CYP1A2CYP3A4HIF1AALDH1A1MAPT | |
| SCHEMBL9364793 | 0.78 | KDM4E (0.67) | CYP1A2CYP3A4HIF1AALDH1A1MAPT | |
| SCHEMBL8543761 | 0.77 | MAPT (0.70) | CYP1A2CYP3A4HIF1AALDH1A1MAPT | |
| SCHEMBL8543768 | 0.77 | MAPT (0.70) | CYP1A2CYP3A4HIF1AALDH1A1MAPT |
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-2006093518-A2 | THIENYL COMPOUNDS FOR TREATING VIRUS-RELATED CONDITIONS | APATH, LLC (US) | 2006-09-08 | — | — | WO | disclosed |