Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | GRK6 | P43250 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14722163 | 1.00 | KDM4E (0.32) | KDM4EMEN1MAPTKMT2AGRK6 | |
| SCHEMBL14722147 | 0.91 | HDAC1 (0.36) | KDM4EMEN1MAPTKMT2ACYP3A4 | |
| SCHEMBL14722146 | 0.91 | HDAC1 (0.36) | KDM4EMEN1MAPTKMT2ACYP3A4 | |
| SCHEMBL14721807 | 0.81 | KDM4E (0.39) | KDM4EMEN1MAPTKMT2AALDH1A1 | |
| SCHEMBL14721722 | 0.81 | TSHR (0.36) | MEN1MAPTKMT2A | |
| SCHEMBL14721726 | 0.81 | TSHR (0.36) | MEN1MAPTKMT2A | |
| SCHEMBL14722314 | 0.76 | CYP1A2 (0.34) | KDM4EMEN1MAPTKMT2ADRD2 | |
| SCHEMBL14725359 | 0.76 | HDAC3 (0.32) | — | |
| SCHEMBL14721749 | 0.75 | TUBB4A (0.36) | ALDH1A1 | |
| SCHEMBL14721747 | 0.75 | TUBB4A (0.36) | ALDH1A1 |
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 |