Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 1/20 | 0.44 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.39 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.38 |
| ▸ | TUBB | P07437 | 1/20 | 0.38 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.38 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.38 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.38 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.38 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.38 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.38 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.38 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.38 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.38 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.38 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.38 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.38 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.38 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.37 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22452928 | 0.85 | DHFR (0.47) | DHFRFFAR4TUBB4ATUBBTUBA3C | |
| SCHEMBL22453358 | 0.81 | MAPT (0.41) | DHFRKDM4CALDH1A1GPR3 | |
| SCHEMBL22453698 | 0.80 | DHFR (0.50) | DHFRTUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL22453357 | 0.80 | KIF11 (0.41) | ALDH1A1SLC6A4SLC6A3SLC6A2KIF11 | |
| SCHEMBL519232 | 0.78 | ALDH1A1 (0.46) | FFAR4ALDH1A1SLC6A3SLC6A2KIF11 | |
| SCHEMBL2056116 | 0.75 | DHFR (0.48) | DHFRFFAR4TUBB4ATUBBTUBA3C | |
| SCHEMBL22452606 | 0.73 | ALDH1A1 (0.38) | ALDH1A1PDE2A | |
| SCHEMBL22681749 | 0.72 | TRPV1 (0.46) | DHFRTUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL12294729 | 0.71 | DHFR (0.43) | DHFRTUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL2056111 | 0.70 | ALDH1A1 (0.50) | DHFRALDH1A1SLC6A4SLC6A3SLC6A2 |
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-2020190774-A1 | NOVEL SMALL MOLECULE INHIBITORS OF TEAD TRANSCRIPTION FACTORS | THE GENERAL HOSPITAL CORPORATION (US) | 2020-09-24 | — | — | WO | disclosed |