Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 10/20 | 0.62 |
| ▸ | PTGS2 | P35354 | 10/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | ESR1 | P03372 | 1/20 | 0.50 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.50 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.46 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.46 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.46 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.46 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.46 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | CSNK1A1L | Q8N752 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11087266 | 0.91 | PTGS2 (0.64) | PTGS1PTGS2ALDH1A1ALOX5CSNK1A1 | |
| SCHEMBL7488369 | 0.91 | PTGS2 (0.64) | PTGS1PTGS2ALDH1A1ALOX5CSNK1A1 | |
| SCHEMBL7084859 | 0.88 | PTGS2 (0.67) | PTGS1PTGS2ALDH1A1HPGDESR1 | |
| SCHEMBL10878849 | 0.86 | PTGS1 (0.62) | PTGS1PTGS2ALDH1A1HPGDESR1 | |
| SCHEMBL7088151 | 0.84 | PTGS1 (0.69) | PTGS1PTGS2ALDH1A1HPGD | |
| SCHEMBL11083668 | 0.81 | ESR1 (0.52) | PTGS1PTGS2ALDH1A1HPGDESR1 | |
| SCHEMBL10852756 | 0.80 | PTGS2 (0.41) | PTGS1PTGS2ALDH1A1ALOX5CSNK1A1 | |
| SCHEMBL11087907 | 0.78 | ESR1 (0.47) | ALDH1A1HPGDESR1ESR2CSNK1A1 | |
| SCHEMBL7084237 | 0.78 | PTGS2 (0.55) | PTGS1PTGS2ALDH1A1ESR1ESR2 | |
| SCHEMBL213705 | 0.78 | PTGS2 (0.70) | PTGS1PTGS2ALDH1A1ESR1ESR2 |
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-4472422-A | Antihypertensive 4,5-diaryl-α-polyfluoro-alkyl-1H-imidazole-2-methanamines | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1984-09-18 | — | — | US | claimed |
| US-4472422-A | Antihypertensive 4,5-diaryl-α-polyfluoro-alkyl-1H-imidazole-2-methanamines | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1984-09-18 | — | — | US | disclosed |