Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP1 | P22413 | 4/20 | 0.67 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.45 |
| ▸ | KDR | P35968 | 7/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.44 |
| ▸ | HDAC9 | Q9UKV0 | 4/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 4/20 | 0.44 |
| ▸ | RAF1 | P04049 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | AURKA | O14965 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL16760460 | 0.87 | ENPP1 (0.67) | ENPP1AURKBMAPK1PDE10AKDR | |
| SCHEMBL8644663 | 0.84 | ENPP1 (0.70) | ENPP1ALDH1A1MAPK1KDR | |
| SCHEMBL29359187 | 0.83 | ENPP1 (0.81) | ENPP1ALDH1A1MAPK1KDRRAF1 | |
| SCHEMBL364049 | 0.83 | ENPP1 (0.81) | ENPP1ALDH1A1MAPK1KDRRAF1 | |
| Hydrochloric Acid SCHEMBL3526531 | 0.81 | ENPP1 (0.79) | ENPP1MAPK1KDRAURKA | |
| SCHEMBL1012109 | 0.80 | ENPP1 (1.00) | ENPP1ALDH1A1MAPK1KDR | |
| SCHEMBL1013282 | 0.80 | ENPP1 (1.00) | ENPP1ALDH1A1MAPK1KDR | |
| SCHEMBL22441608 | 0.80 | ENPP1 (0.78) | ENPP1AURKBALDH1A1MAPK1KDR | |
| SCHEMBL31457605 | 0.80 | ENPP1 (0.78) | ENPP1AURKBALDH1A1MAPK1KDR | |
| SCHEMBL30591048 | 0.80 | ENPP1 (1.00) | ENPP1ALDH1A1MAPK1KDR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2015079251-A1 | QUINAZOLINE COMPOUNDS | CANCER RESEARCH TECHNOLOGY LIMITED (GB) | 2015-06-04 | — | — | WO | disclosed |
| WO-2015079251-A1 | QUINAZOLINE COMPOUNDS | CANCER RESEARCH TECHNOLOGY LIMITED (GB) | 2015-06-04 | — | — | WO | disclosed |