Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFKB1 | P19838 | 13/20 | 0.47 |
| ▸ | JUN | P05412 | 12/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 12/20 | 0.47 |
| ▸ | RELA | Q04206 | 12/20 | 0.47 |
| ▸ | XPO1 | O14980 | 3/20 | 0.41 |
| ▸ | ATF1 | P18846 | 2/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.37 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.35 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.35 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.35 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.35 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.35 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.35 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.35 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.35 |
| ▸ | AGBL2 | Q5U5Z8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4769616 | 0.86 | NFKB1 (0.46) | NFKB1JUNNFKB2RELAXPO1 | |
| SCHEMBL4769975 | 0.78 | ATF1 (0.39) | NFKB1ATF1AKR1C3AKR1C2 | |
| SCHEMBL4768134 | 0.77 | P4HTM (0.35) | AKR1C3AKR1C2 | |
| SCHEMBL4773852 | 0.74 | PPARG (0.41) | — | |
| SCHEMBL4764854 | 0.73 | CCKAR (0.45) | AKR1C3AKR1C2 | |
| SCHEMBL4775298 | 0.73 | ACHE (0.41) | AKR1C3AKR1C2ITGB1ITGA4 | |
| SCHEMBL4773748 | 0.72 | KMT2A (0.35) | — | |
| SCHEMBL4774405 | 0.71 | GSK3B (0.48) | — | |
| SCHEMBL4768165 | 0.69 | CTSA (0.38) | — | |
| SCHEMBL5766191 | 0.69 | AKR1C3 (0.47) | AKR1C3AKR1C2PSEN1PSEN2APH1B |
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-1581531-B1 | PYRIDINO¬2,3-D PYRIMIDINE DERIVATIVES AS SELECTIIVE KDR AND FGFR INHIBITORS | HOFFMANN LA ROCHE (CH) | 2008-02-27 | — | — | EP | claimed |