Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.53 |
| ▸ | CASP1 | P29466 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | ESRRG | P62508 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL4604655 | 0.83 | ALDH1A1 (0.62) | ALDH1A1CYP3A4ALOX15TSHRHIF1A | |
| SCHEMBL5074350 | 0.78 | ALDH1A1 (0.64) | ALDH1A1CYP3A4ALOX15TSHRHIF1A | |
| SCHEMBL23828174 | 0.73 | ALDH1A1 (0.62) | ALDH1A1CYP3A4ALOX15TSHRHIF1A | |
| SCHEMBL49805 | 0.73 | ALDH1A1 (1.00) | ALDH1A1CYP3A4ALOX15TSHRHIF1A | |
| SCHEMBL11764680 | 0.72 | ALDH1A1 (0.72) | ALDH1A1CYP3A4ALOX15TSHRHIF1A | |
| SCHEMBL142559 | 0.71 | ALDH1A1 (0.58) | ALDH1A1CYP3A4ALOX15TSHRHIF1A | |
| SCHEMBL7720749 | 0.70 | ALDH1A1 (0.56) | ALDH1A1CYP3A4ALOX15TSHRHIF1A | |
| SCHEMBL14283534 | 0.69 | TSHR (0.67) | ALDH1A1CYP3A4ALOX15TSHRHIF1A | |
| SCHEMBL9874686 | 0.67 | ALDH1A1 (0.86) | ALDH1A1CYP3A4ALOX15TSHRHIF1A | |
| SCHEMBL11482583 | 0.67 | ALDH1A1 (0.86) | ALDH1A1CYP3A4ALOX15TSHRHIF1A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5929166-A | RUBBER BLENDED WITH POLYSILOXANE HYDROSILATED WITH AN NITROGEN-SUBSTITUTED PHENYLENEDIAMINE COMPOUND AS ANTIOXIDANT; AUTOMOBILE TIRES | RHONE-POULENC CHIMIE (FR) | 1999-07-27 | — | — | US | disclosed |
| US-5733999-A | HYDRIOPOLYSILOXANES MODIFIED BY AN UNSATURATED N,N',N'-TRIALKYLDIAMINOBENZENE; ANTICRACKING AGENTS | RHONE-POULENC CHIMIE (FR) | 1998-03-31 | — | — | US | disclosed |