Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 4/20 | 0.41 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11510982 | 0.84 | SMN1; SMN2 (0.50) | ALDH1A1SMN1; SMN2GAANPC1RAB9A | |
| SCHEMBL11512682 | 0.83 | KMT2A (0.50) | ALDH1A1SMN1; SMN2GAAHTTLMNA | |
| SCHEMBL11509941 | 0.71 | MAPT (0.37) | ALDH1A1SMN1; SMN2GAANPC1RAB9A | |
| SCHEMBL11512125 | 0.70 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2GAANPC1RAB9A | |
| SCHEMBL6510534 | 0.70 | ALDH1A1 (0.63) | ALDH1A1SMN1; SMN2GAANPC1RAB9A | |
| SCHEMBL11594001 | 0.68 | CACNA2D1 (0.42) | ALDH1A1SMN1; SMN2GAANPC1RAB9A | |
| SCHEMBL11509252 | 0.67 | HPGD (0.49) | ALDH1A1SMN1; SMN2RAB9AHTTCYP3A4 | |
| SCHEMBL11485827 | 0.66 | PTGES (0.79) | GAARAB9ALMNAHPGDMAPT | |
| SCHEMBL11512018 | 0.65 | NPC1 (0.54) | ALDH1A1SMN1; SMN2GAANPC1RAB9A | |
| SCHEMBL13064657 | 0.64 | NR5A1 (0.70) | ALDH1A1SMN1; SMN2GAANPC1RAB9A |
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-4178253-A | 1,2,4-TRIAZOLE COMPOUNDS | CIBA-GEIGY CORPORATION (US) | 1979-12-11 | — | — | US | disclosed |