Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.58 |
| ▸ | TAS2R38 | P59533 | 3/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.58 |
| ▸ | TYR | P14679 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8701487 | 0.89 | ALDH1A1 (0.63) | ALDH1A1TAS2R38HSD17B10TP53TYR | |
| SCHEMBL9297667 | 0.83 | ALDH1A1 (0.54) | ALDH1A1TAS2R38HSD17B10TP53TYR | |
| Phenylthiourea SCHEMBL11820844 | 0.76 | ALDH1A1 (1.00) | ALDH1A1TAS2R38HSD17B10TP53TYR | |
| Phenylthiourea SCHEMBL42753 | 0.76 | ALDH1A1 (1.00) | ALDH1A1TAS2R38HSD17B10TP53TYR | |
| SCHEMBL11883991 | 0.76 | ALDH1A1 (0.62) | ALDH1A1TAS2R38HSD17B10TP53TYR | |
| SCHEMBL27687014 | 0.74 | ALDH1A1 (0.45) | ALDH1A1TAS2R38HSD17B10TP53TYR | |
| Phenylthiourea SCHEMBL28966870 | 0.74 | ALDH1A1 (0.95) | ALDH1A1TAS2R38HSD17B10TP53TYR | |
| Phenylthiourea SCHEMBL6644561 | 0.74 | ALDH1A1 (0.95) | ALDH1A1TAS2R38HSD17B10TP53TYR | |
| Phenylthiourea SCHEMBL22494152 | 0.74 | ALDH1A1 (0.95) | ALDH1A1TAS2R38HSD17B10TP53TYR | |
| SCHEMBL4047674 | 0.74 | KMT2A (0.76) | ALDH1A1TAS2R38HSD17B10TP53TYR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0622245-B1 | Thermal recording material | JUJO PAPER CO LTD (JP) | 1998-12-23 | — | — | EP | disclosed |
| EP-0838345-A1 | Thermal recording material | NIPPON PAPER INDUSTRIES CO., LTD. (JP) | 1998-04-29 | — | — | EP | disclosed |
| US-5494882-A | CONTAINING A DITHIOUREA COMPOUND | NIPPON PAPER INDUSTRIES CO., LTD. (JP) | 1996-02-27 | — | — | US | disclosed |
| EP-0622245-A1 | Thermal recording material | NIPPON PAPER INDUSTRIES CO., LTD. (JP) | 1994-11-02 | — | — | EP | disclosed |