Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 4/20 | 0.36 |
| ▸ | LMNA | P02545 | 4/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | XBP1 | P17861 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CES2 | O00748 | 2/20 | 0.33 |
| ▸ | CES1 | P23141 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | DAO | P14920 | 1/20 | 0.33 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22423740 | 0.84 | ALDH1A1 (0.40) | ALDH1A1MAPK1TDP1ATMLMNA | |
| SCHEMBL27552212 | 0.70 | ALDH1A1 (0.35) | ALDH1A1MAPK1TDP1TSHRCES2 | |
| SCHEMBL27278216 | 0.69 | TDP1 (0.40) | ALDH1A1MAPK1TDP1LMNASMN1; SMN2 | |
| SCHEMBL10716596 | 0.69 | ATM (0.55) | ALDH1A1TDP1ATMLMNASMN1; SMN2 | |
| SCHEMBL1307988 | 0.69 | ALDH1A1 (0.44) | ALDH1A1MAPK1TDP1MAPTTSHR | |
| SCHEMBL7365926 | 0.69 | MEN1 (0.46) | ALDH1A1MAPK1TDP1LMNASMN1; SMN2 | |
| SCHEMBL186779 | 0.69 | ALDH1A1 (0.44) | ALDH1A1MAPK1TDP1MAPTTSHR | |
| SCHEMBL560304 | 0.69 | MEN1 (0.46) | ALDH1A1MAPK1TDP1LMNASMN1; SMN2 | |
| SCHEMBL566341 | 0.69 | ALDH1A1 (0.44) | ALDH1A1MAPK1TDP1MAPTTSHR | |
| SCHEMBL2098803 | 0.69 | MEN1 (0.46) | ALDH1A1MAPK1TDP1LMNASMN1; SMN2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0449699-A2 | Pyrazole derivatives as angiotensin II-receptor antagonists, process for their preparation and pharmaceutical compositions containing them | LABORATOIRES UPSA (FR) | 1991-10-02 | — | — | EP | disclosed |