Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.65 |
| ▸ | AURKA | O14965 | 1/20 | 0.58 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.58 |
| ▸ | ESRRB | O95718 | 1/20 | 0.58 |
| ▸ | ESR1 | P03372 | 1/20 | 0.58 |
| ▸ | ESRRA | P11474 | 1/20 | 0.58 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | HPGD | P15428 | 3/20 | 0.54 |
| ▸ | PTGES | O14684 | 1/20 | 0.54 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | CASP7 | P55210 | 1/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | ELANE | P08246 | 1/20 | 0.54 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.51 |
| ▸ | DHODH | Q02127 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10865179 | 0.91 | ESR1 (0.65) | MAPK1AURKAAURKBESRRBESR1 | |
| SCHEMBL6534510 | 0.88 | MAPK1 (0.55) | MAPK1AURKAAURKBESRRBESR1 | |
| SCHEMBL8956330 | 0.86 | MAPK1 (0.85) | MAPK1AURKAAURKBALDH1A1HPGD | |
| SCHEMBL10865067 | 0.85 | DHODH (0.68) | MAPK1AURKAAURKBESRRBESR1 | |
| SCHEMBL10864870 | 0.85 | DHODH (0.68) | MAPK1AURKAAURKBESRRBESR1 | |
| SCHEMBL8410911 | 0.84 | MAPK1 (0.82) | MAPK1AURKAAURKBESR1ESR2 | |
| SCHEMBL785473 | 0.83 | ACHE (0.61) | MAPK1ESRRBESR1ESRRAESR2 | |
| SCHEMBL29793367 | 0.83 | ACHE (0.61) | MAPK1ESRRBESR1ESRRAESR2 | |
| SCHEMBL10864863 | 0.83 | DHODH (0.58) | MAPK1ESRRBESR1ESRRAESR2 | |
| SCHEMBL10865512 | 0.83 | LMNA (0.62) | MAPK1ESRRBESR1ESRRAESR2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0168812-A1 | 4-Amino-2-phenyl quinolines, methods and intermediates for their preparation and medicaments containing them | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1986-01-22 | — | — | EP | disclosed |
| US-4560692-A | ANTICONVULSANTS OR ANXIOLYTIC AGENTS | HOFFMANN-LA ROCHE INC. (US) | 1985-12-24 | — | — | US | disclosed |