Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A1 | P22736 | 1/20 | 0.46 |
| ▸ | KDR | P35968 | 2/20 | 0.45 |
| ▸ | FLT1 | P17948 | 1/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | TTBK1 | Q5TCY1 | 4/20 | 0.43 |
| ▸ | TTBK2 | Q6IQ55 | 4/20 | 0.43 |
| ▸ | EGFR | P00533 | 5/20 | 0.43 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 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 | |
|---|---|---|---|---|
| SCHEMBL27962184 | 0.83 | CA1 (0.62) | KDREGFRLMNACA1CA2 | |
| SCHEMBL9607630 | 0.82 | ABCG2 (0.50) | KDRFLT1TTBK1TTBK2EGFR | |
| SCHEMBL27971500 | 0.77 | ESR1 (0.74) | ESR1ALDH1A1MAPK1SMN1; SMN2KDM4E | |
| SCHEMBL6918294 | 0.76 | F9 (0.52) | NR4A1ESR1TTBK1TTBK2EGFR | |
| SCHEMBL9046753 | 0.74 | PGK1 (0.41) | EGFRPDPK1MAPTALDH1A1POLB | |
| SCHEMBL17815587 | 0.74 | GALR3 (0.58) | TTBK1TTBK2EGFRMAPTALDH1A1 | |
| SCHEMBL6345655 | 0.74 | PIK3CA (0.50) | MAPTALDH1A1POLBGAAL3MBTL1 | |
| SCHEMBL23357588 | 0.74 | BCL6 (0.53) | MAPTALDH1A1HTTSMN1; SMN2LMNA | |
| SCHEMBL1896427 | 0.73 | TTBK1 (0.55) | KDRFLT1TTBK1TTBK2EGFR | |
| SCHEMBL16257538 | 0.73 | EGFR (0.61) | EGFRMAPTMAPK1HTTKDM4E |
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-2011017296-A1 | 4, 5, 6-TRISUBSTITUTED PYRIMIDINE DERIVATIVES AS FACTOR IXA INHIBITORS | SCHERING CORPORATION (US) | 2011-02-10 | — | — | WO | disclosed |