Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.47 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.47 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.47 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.47 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.47 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.47 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.46 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.44 |
| ▸ | CLPP | Q16740 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL22720441 | 0.87 | KMT2A (0.49) | KMT2AKDM4EALDH1A1MAPTGLA | |
| SCHEMBL172809 | 0.86 | C5AR1 (0.51) | KMT2AKDM4EALDH1A1MAPTGLA | |
| SCHEMBL786788 | 0.86 | KMT2A (0.47) | KMT2AKDM4EALDH1A1MAPTGLA | |
| SCHEMBL5999914 | 0.85 | KMT2A (0.54) | KMT2AKDM4EALDH1A1MAPTGLA | |
| SCHEMBL31095294 | 0.81 | C5AR1 (0.60) | KMT2AKDM4EALDH1A1MAPTGLA | |
| SCHEMBL1831804 | 0.81 | C5AR1 (0.60) | KMT2AKDM4EALDH1A1MAPTGLA | |
| SCHEMBL22720440 | 0.80 | KMT2A (0.49) | KMT2AKDM4EALDH1A1MAPTGLA | |
| SCHEMBL5999840 | 0.80 | KMT2A (0.56) | KMT2AKDM4EALDH1A1MAPTGLA | |
| SCHEMBL5776588 | 0.79 | KMT2A (0.53) | KMT2AKDM4EALDH1A1MAPTGLA | |
| SCHEMBL10036330 | 0.79 | KMT2A (0.55) | KMT2AKDM4EALDH1A1MAPTGLA |
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-1318814-B1 | TRIAZOLE COMPOUNDS USEFUL AS PROTEIN KINASE INHIBITORS | VERTEX PHARMA (US) | 2007-05-30 | — | — | EP | disclosed |