Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.55 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.55 |
| ▸ | F7 | P08709 | 3/20 | 0.55 |
| ▸ | F3 | P13726 | 3/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.55 |
| ▸ | OXER1 | Q8TDS5 | 3/20 | 0.55 |
| ▸ | PPARG | P37231 | 3/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.55 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | PPARD | Q03181 | 2/20 | 0.55 |
| ▸ | PPARA | Q07869 | 2/20 | 0.55 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.55 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.55 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL517868 | 1.00 | ALDH1A1 (0.55) | ALDH1A1CYP19A1F7F3MAPT | |
| SCHEMBL21260658 | 1.00 | ALDH1A1 (0.55) | ALDH1A1CYP19A1F7F3MAPT | |
| SCHEMBL22593884 | 1.00 | ALDH1A1 (0.55) | ALDH1A1CYP19A1F7F3MAPT | |
| SCHEMBL2806976 | 1.00 | ALDH1A1 (0.55) | ALDH1A1CYP19A1F7F3MAPT | |
| SCHEMBL3623436 | 1.00 | ALDH1A1 (0.55) | ALDH1A1CYP19A1F7F3MAPT | |
| SCHEMBL18883668 | 1.00 | ALDH1A1 (0.55) | ALDH1A1CYP19A1F7F3MAPT | |
| Hydrochloric Acid SCHEMBL8633718 | 0.98 | ALDH1A1 (0.53) | ALDH1A1CYP19A1F7F3MAPT | |
| SCHEMBL17977145 | 0.98 | ALDH1A1 (0.52) | ALDH1A1CYP19A1F7F3MAPT | |
| SCHEMBL7074243 | 0.98 | ALDH1A1 (0.52) | ALDH1A1CYP19A1F7F3MAPT | |
| SCHEMBL7074247 | 0.98 | ALDH1A1 (0.52) | ALDH1A1CYP19A1F7F3MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0421441-B1 | Pantothenic acid derivatives | FUJIREBIO KK (JP) | 1995-01-25 | — | — | EP | disclosed |
| US-5120738-A | Cardiovascular disorders | FUJIREBIO INC. (JP) | 1992-06-09 | — | — | US | disclosed |
| EP-0421441-A2 | Pantothenic acid derivatives | FUJIREBIO INC. (JP) | 1991-04-10 | — | — | EP | disclosed |