Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 3/20 | 0.38 |
| ▸ | FLT3 | P36888 | 2/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.36 |
| ▸ | AAK1 | Q2M2I8 | 5/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | SLC10A2 | Q12908 | 1/20 | 0.34 |
| ▸ | CIT | O14578 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14725510 | 1.00 | GSK3B (0.38) | GSK3BFLT3KDRPDK1AAK1 | |
| SCHEMBL14721711 | 0.85 | GSK3B (0.36) | GSK3BFLT3KDRPDK1AAK1 | |
| SCHEMBL14725450 | 0.84 | AAK1 (0.43) | AAK1CIT | |
| SCHEMBL14721685 | 0.84 | AAK1 (0.43) | AAK1CIT | |
| SCHEMBL14725511 | 0.83 | SRC (0.40) | AAK1KDM4EALDH1A1 | |
| SCHEMBL14725538 | 0.77 | KDM4E (0.39) | KDM4EALDH1A1HPGD | |
| SCHEMBL14722148 | 0.76 | TUBB4A (0.48) | KDM4EALDH1A1HPGD | |
| SCHEMBL14721851 | 0.76 | TUBB4A (0.48) | FLT3KDRKDM4EALDH1A1HPGD | |
| Hydrochloric Acid SCHEMBL14722766 | 0.75 | TUBB4A (0.47) | KDM4EALDH1A1HPGD | |
| SCHEMBL14725545 | 0.74 | AAK1 (0.35) | GSK3BFLT3KDRAAK1CIT |
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-2013026942-A1 | TUBULIN BINDING AGENTS | THE PROVOST, FELLOWS, FOUNDATION SCHOLARS, AND THE OTHER MEMBERS OF BOARD, OF THE COLLEGE OF THE HOLY AND UNDIVIDED TRINITY OF QUEEN ELIZABETH, NEAR DUBLIN (IE) | 2013-02-28 | — | — | WO | disclosed |