Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC2A1 | P11166 | 1/20 | 0.54 |
| ▸ | EGFR | P00533 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | GLA | P06280 | 1/20 | 0.49 |
| ▸ | CASP1 | P29466 | 1/20 | 0.49 |
| ▸ | CASP7 | P55210 | 1/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.45 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6102320 | 0.91 | SLC2A1 (0.58) | SLC2A1EGFRMAPTKDM4EALDH1A1 | |
| SCHEMBL28255681 | 0.90 | SLC2A1 (0.63) | SLC2A1EGFRMAPTKDM4EALDH1A1 | |
| SCHEMBL4765793 | 0.88 | MAPT (0.49) | SLC2A1EGFRMAPTKDM4EALDH1A1 | |
| SCHEMBL6883774 | 0.86 | HSD17B1 (0.59) | SLC2A1EGFRMAPTKDM4EALDH1A1 | |
| SCHEMBL7402540 | 0.86 | SLC2A1 (0.56) | SLC2A1EGFRKDM4EALDH1A1GAA | |
| SCHEMBL8134690 | 0.85 | SLC2A1 (0.52) | SLC2A1EGFRMAPTKDM4EALDH1A1 | |
| SCHEMBL1528983 | 0.84 | CA1 (0.61) | SLC2A1EGFRMAPTKDM4EALDH1A1 | |
| SCHEMBL12002526 | 0.84 | SLC2A1 (0.54) | SLC2A1EGFRMAPTKDM4EALDH1A1 | |
| SCHEMBL4710854 | 0.84 | SLC2A1 (0.54) | SLC2A1EGFRMAPTKDM4EALDH1A1 | |
| SCHEMBL4465627 | 0.84 | RARB (0.51) | SLC2A1EGFRALDH1A1HPGDHSD17B10 |
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-1368337-B1 | PIPERAZINE DERIVATIVES AND THEIR USE AS 5-HT1B LIGANDS | SMITHKLINE BEECHAM PLC (GB) | 2005-06-15 | — | — | EP | disclosed |