Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 4/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.34 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.31 |
| ▸ | TUBB | P07437 | 2/20 | 0.31 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.31 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.31 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.31 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.31 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14721320 | 0.85 | ALDH1A1 (0.32) | ALDH1A1HPGDMEN1KMT2AABCB1 | |
| SCHEMBL14722102 | 0.85 | MEN1 (0.32) | ALDH1A1HPGDMEN1KMT2AABCB1 | |
| SCHEMBL14725473 | 0.84 | ALDH1A1 (0.35) | ALDH1A1HPGDMEN1KMT2AABCB1 | |
| SCHEMBL14722361 | 0.83 | ALDH1A1 (0.44) | ALDH1A1MEN1KMT2AKDM4EMAPK1 | |
| Bromide SCHEMBL14722943 | 0.82 | ALDH1A1 (0.43) | ALDH1A1MEN1KMT2AKDM4EMAPK1 | |
| SCHEMBL14721961 | 0.81 | CYP19A1 (0.39) | ALDH1A1HPGDMEN1KMT2AABCB1 | |
| SCHEMBL14722118 | 0.78 | ALDH1A1 (0.35) | ALDH1A1HPGDMEN1KMT2ALMNA | |
| SCHEMBL14721638 | 0.78 | TUBB4A (0.34) | ALDH1A1HPGDMEN1KMT2AABCB1 | |
| SCHEMBL14723556 | 0.78 | TUBB4A (0.34) | ALDH1A1HPGDMEN1KMT2AABCB1 | |
| SCHEMBL14721807 | 0.77 | KDM4E (0.39) | ALDH1A1HPGDMEN1KMT2AABCB1 |
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 |