Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.55 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.55 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.55 |
| ▸ | MAPK10 | P53779 | 5/20 | 0.55 |
| ▸ | JAK2 | O60674 | 6/20 | 0.53 |
| ▸ | JAK3 | P52333 | 3/20 | 0.53 |
| ▸ | TTK | P33981 | 1/20 | 0.53 |
| ▸ | BRD4 | O60885 | 2/20 | 0.50 |
| ▸ | JUN | P05412 | 4/20 | 0.49 |
| ▸ | MAPK8 | P45983 | 4/20 | 0.49 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.47 |
| ▸ | CDK2 | P24941 | 2/20 | 0.47 |
| ▸ | CDK4 | P11802 | 1/20 | 0.47 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.47 |
| ▸ | CCND3 | P30281 | 1/20 | 0.47 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.47 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.47 |
| ▸ | EGFR | P00533 | 1/20 | 0.46 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL18376748 | 0.89 | EGFR (0.57) | MAPK10JAK2JAK3BRD4CDK2 | |
| SCHEMBL18376775 | 0.89 | PTK2 (0.51) | MAPK10JAK2JAK3BRD4PTK2 | |
| SCHEMBL18376759 | 0.86 | MAPK10 (0.53) | MAPK10JAK2JAK3BRD4PTK2 | |
| SCHEMBL18376850 | 0.86 | JAK2 (0.72) | HDAC3HDAC1HDAC2HDAC6MAPK10 | |
| SCHEMBL18376849 | 0.83 | JAK2 (0.61) | HDAC3HDAC1HDAC2HDAC6MAPK10 | |
| SCHEMBL29370855 | 0.83 | TTK (0.61) | HDAC3HDAC1HDAC2HDAC6MAPK10 | |
| SCHEMBL18376727 | 0.83 | TTK (0.61) | HDAC3HDAC1HDAC2HDAC6MAPK10 | |
| SCHEMBL28680804 | 0.82 | TTK (0.53) | HDAC3HDAC1HDAC2HDAC6MAPK10 | |
| SCHEMBL30859695 | 0.82 | TTK (0.65) | HDAC3HDAC1HDAC2HDAC6MAPK10 | |
| SCHEMBL18376252 | 0.82 | TTK (0.65) | HDAC3HDAC1HDAC2HDAC6MAPK10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017005137-A1 | QUINAZOLINE COMPOUND, INTERMEDIATE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USES THEREOF | 吉林大学 | 2017-01-12 | — | — | WO | disclosed |