Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA4 | P22748 | 1/20 | 0.56 |
| ▸ | EGFR | P00533 | 2/20 | 0.54 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.54 |
| ▸ | KDR | P35968 | 2/20 | 0.54 |
| ▸ | LTA4H | P09960 | 2/20 | 0.54 |
| ▸ | CES1 | P23141 | 1/20 | 0.51 |
| ▸ | CASP1 | P29466 | 1/20 | 0.51 |
| ▸ | CASP14 | P31944 | 1/20 | 0.51 |
| ▸ | CASP3 | P42574 | 1/20 | 0.51 |
| ▸ | CASP2 | P42575 | 1/20 | 0.51 |
| ▸ | CASP4 | P49662 | 1/20 | 0.51 |
| ▸ | CASP5 | P51878 | 1/20 | 0.51 |
| ▸ | CASP7 | P55210 | 1/20 | 0.51 |
| ▸ | CASP9 | P55211 | 1/20 | 0.51 |
| ▸ | CASP6 | P55212 | 1/20 | 0.51 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.51 |
| ▸ | CASP12 | Q6UXS9 | 1/20 | 0.51 |
| ▸ | CASP10 | Q92851 | 1/20 | 0.51 |
| ▸ | MERTK | Q12866 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 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 | |
|---|---|---|---|---|
| SCHEMBL5277509 | 1.00 | CA4 (0.56) | CA4EGFRPDGFRBKDRLTA4H | |
| SCHEMBL13241204 | 0.94 | EGFR (0.50) | CA4EGFRPDGFRBKDRLTA4H | |
| SCHEMBL12047752 | 0.94 | EGFR (0.50) | CA4EGFRPDGFRBKDRLTA4H | |
| SCHEMBL114319 | 0.91 | CA1 (0.61) | EGFRPDGFRBKDRCES1CASP1 | |
| SCHEMBL13241207 | 0.90 | EGFR (0.50) | CA4EGFRPDGFRBKDRLTA4H | |
| SCHEMBL9480806 | 0.89 | RAB9A (0.61) | EGFRPDGFRBKDRMERTKKDM4E | |
| SCHEMBL12048277 | 0.89 | EGFR (0.47) | CA4EGFRPDGFRBKDRLTA4H | |
| Hydrochloric Acid SCHEMBL29089898 | 0.88 | CA1 (0.58) | EGFRPDGFRBKDRCES1CASP1 | |
| SCHEMBL12047852 | 0.87 | EGFR (0.46) | CA4EGFRPDGFRBKDRLTA4H | |
| SCHEMBL12048227 | 0.87 | ACHE (0.52) | CA4EGFRPDGFRBKDRLTA4H |
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-5210065-A | A mixture of an aromatic amine, an oxidizer and an acid | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1993-05-11 | — | — | US | disclosed |
| EP-0479578-A1 | Color-forming recording material | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1992-04-08 | — | — | EP | disclosed |