Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 6/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.35 |
| ▸ | ABCG2 | Q9UNQ0 | 6/20 | 0.35 |
| ▸ | ABCB1 | P08183 | 5/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.32 |
| ▸ | TUBB | P07437 | 1/20 | 0.32 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.32 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.32 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.32 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.32 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.32 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.32 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.32 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.32 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14722361 | 0.85 | ALDH1A1 (0.44) | ALDH1A1MEN1KMT2ATUBB4ATUBB | |
| SCHEMBL14722942 | 0.84 | ALDH1A1 (0.34) | ALDH1A1HPGDMEN1KMT2AABCG2 | |
| Bromide SCHEMBL14722943 | 0.84 | ALDH1A1 (0.43) | ALDH1A1MEN1KMT2ATUBB4ATUBB | |
| SCHEMBL14722118 | 0.76 | ALDH1A1 (0.35) | ALDH1A1HPGDMEN1KMT2AKDM4E | |
| SCHEMBL14725538 | 0.73 | KDM4E (0.39) | ALDH1A1HPGDMEN1KMT2AABCG2 | |
| SCHEMBL14721320 | 0.72 | ALDH1A1 (0.32) | ALDH1A1HPGDMEN1KMT2AABCG2 | |
| SCHEMBL14722102 | 0.72 | MEN1 (0.32) | ALDH1A1HPGDMEN1KMT2AABCG2 | |
| SCHEMBL14725341 | 0.70 | TUBB4A (0.41) | MEN1KMT2AABCG2ABCB1TUBB4A | |
| SCHEMBL14725340 | 0.69 | TUBB4A (0.40) | MEN1KMT2AABCG2ABCB1TUBB4A | |
| SCHEMBL14725338 | 0.66 | TUBB4A (0.37) | ALDH1A1TUBB4ATUBBTUBA3CTUBA1B |
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 |