Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.47 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.46 |
| ▸ | TUBB | P07437 | 2/20 | 0.46 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.46 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.46 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.46 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.46 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.46 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.46 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.46 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.46 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.46 |
| ▸ | TUBA1C | Q9BQE3 | 2/20 | 0.46 |
| ▸ | TUBB6 | Q9BUF5 | 2/20 | 0.46 |
| ▸ | TUBB2B | Q9BVA1 | 2/20 | 0.46 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL27929922 | 0.88 | PDK1 (0.52) | ALDH1A1TDP1TUBB4ATUBBTUBA3C | |
| SCHEMBL17823329 | 0.83 | LMNA (0.49) | ALDH1A1TDP1TUBB4ATUBBTUBA3C | |
| SCHEMBL4063903 | 0.82 | ALDH1A1 (0.61) | ALDH1A1TDP1TUBB4ATUBBTUBA3C | |
| SCHEMBL29650091 | 0.82 | ALDH1A1 (0.61) | ALDH1A1TDP1TUBB4ATUBBTUBA3C | |
| SCHEMBL28218587 | 0.80 | ALDH1A1 (0.59) | ALDH1A1TDP1TUBB4ATUBBTUBA3C | |
| SCHEMBL7244318 | 0.80 | TSHR (0.51) | ALDH1A1TDP1MAPTKMT2AMEN1 | |
| SCHEMBL30768275 | 0.79 | ALDH1A1 (0.46) | ALDH1A1TDP1TUBB4ATUBBTUBA3C | |
| SCHEMBL27085813 | 0.78 | ALDH1A1 (0.50) | ALDH1A1TDP1TUBB4ATUBBTUBA3C | |
| SCHEMBL9035409 | 0.78 | PDK1 (0.56) | ALDH1A1MAPTKMT2AMEN1MAPK1 | |
| Cyanide SCHEMBL11163252 | 0.78 | ALDH1A1 (0.56) | ALDH1A1TDP1TUBB4ATUBBTUBA3C |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3600307-A1 | COMPOSITIONS FOR USE IN METHODS OF INHIBITING PROTEIN KINASES | University of Houston System (US) | 2020-02-05 | — | — | EP | disclosed |
| WO-2018183633-A1 | COMPOSITIONS FOR USE IN METHODS OF INHIBITING PROTEIN KINASES | UNIVERSITY OF HOUSTON SYSTEM (US) | 2018-10-04 | — | — | WO | disclosed |