Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10667959 | 0.85 | GAA (0.50) | ALDH1A1TSHRHPGDALOX15GAA | |
| SCHEMBL10667210 | 0.85 | GAA (0.47) | ALDH1A1TSHRHPGDALOX15GAA | |
| SCHEMBL10664220 | 0.84 | ALDH1A1 (0.46) | ALDH1A1TSHRHPGDALOX15GAA | |
| Hydrochloric Acid SCHEMBL10667219 | 0.84 | GAA (0.49) | ALDH1A1TSHRHPGDALOX15GAA | |
| SCHEMBL1412496 | 0.80 | CYP19A1 (0.55) | ALDH1A1CYP19A1HPGDALOX15MAPT | |
| SCHEMBL12809617 | 0.78 | POLB (0.55) | ALDH1A1TSHRCYP19A1HPGDALOX15 | |
| SCHEMBL11115154 | 0.77 | GAA (0.46) | ALDH1A1TSHRHPGDALOX15GAA | |
| SCHEMBL11117131 | 0.77 | ALDH1A1 (0.48) | ALDH1A1TSHRHPGDALOX15GAA | |
| SCHEMBL10666333 | 0.76 | NPSR1 (0.57) | ALDH1A1GAALMNAMEN1KMT2A | |
| SCHEMBL22795533 | 0.74 | CYP19A1 (0.57) | ALDH1A1CYP19A1HPGDALOX15GAA |
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 |
|---|---|---|---|---|---|---|---|
| US-4789680-A | Aralkyltriazole compounds | CIBA-GEIGY CORPORATION (US) | 1988-12-06 | — | — | US | disclosed |