Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNK2 | Q07912 | 1/20 | 0.45 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 5/20 | 0.42 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | CTSK | P43235 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | CTSS | P25774 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | NQO1 | P15559 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.40 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.40 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.40 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL19852876 | 0.80 | KCNH2 (0.51) | TNK2CACNA2D1ALDH1A1GAANPC1 | |
| SCHEMBL26923510 | 0.78 | NPC1 (0.50) | NPC1RAB9ACTSKCTSSMEN1 | |
| SCHEMBL11198232 | 0.78 | CACNA2D1 (0.43) | TNK2CACNA2D1ALDH1A1GAAKDM4E | |
| SCHEMBL12960814 | 0.74 | HRH3 (0.55) | CACNA2D1ALDH1A1GAANPC1RAB9A | |
| SCHEMBL13048467 | 0.73 | NQO1 (0.70) | ALDH1A1GAAKDM4ENPC1RAB9A | |
| Methylamine SCHEMBL28783432 | 0.71 | HRH3 (0.53) | CACNA2D1ALDH1A1GAANPC1RAB9A | |
| SCHEMBL5833291 | 0.71 | NQO1 (0.82) | ALDH1A1GAAKDM4ENPC1RAB9A | |
| SCHEMBL18417193 | 0.71 | NQO1 (0.82) | ALDH1A1GAAKDM4ENPC1RAB9A | |
| SCHEMBL9155582 | 0.71 | NQO1 (0.82) | ALDH1A1GAAKDM4ENPC1RAB9A | |
| SCHEMBL3620507 | 0.70 | TNK2 (0.47) | TNK2CACNA2D1ALDH1A1GAAMAPT |
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-3986140-A | 2,4,6 Trisubstituted pyridine dye lasers | INTERNATIONAL BUSINESS MACHINES CORPORATION (US) | 1976-10-12 | — | — | US | disclosed |