Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 4/20 | 0.35 |
| ▸ | BCHE | P06276 | 3/20 | 0.35 |
| ▸ | TUBB4A | P04350 | 14/20 | 0.34 |
| ▸ | TUBB | P07437 | 14/20 | 0.34 |
| ▸ | TUBA3C | P0DPH7 | 14/20 | 0.34 |
| ▸ | TUBA1B | P68363 | 14/20 | 0.34 |
| ▸ | TUBA4A | P68366 | 14/20 | 0.34 |
| ▸ | TUBB4B | P68371 | 14/20 | 0.34 |
| ▸ | TUBB3 | Q13509 | 14/20 | 0.34 |
| ▸ | TUBB2A | Q13885 | 14/20 | 0.34 |
| ▸ | TUBB8 | Q3ZCM7 | 14/20 | 0.34 |
| ▸ | TUBA3E | Q6PEY2 | 14/20 | 0.34 |
| ▸ | TUBA1A | Q71U36 | 14/20 | 0.34 |
| ▸ | TUBA1C | Q9BQE3 | 14/20 | 0.34 |
| ▸ | TUBB6 | Q9BUF5 | 14/20 | 0.34 |
| ▸ | TUBB2B | Q9BVA1 | 14/20 | 0.34 |
| ▸ | TUBB1 | Q9H4B7 | 14/20 | 0.34 |
| ▸ | KDR | P35968 | 5/20 | 0.33 |
| ▸ | FLT1 | P17948 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6232974 | 0.83 | ACHE (0.35) | ACHEBCHETUBB4ATUBBTUBA3C | |
| SCHEMBL4171116 | 0.80 | TUBB4A (0.55) | TUBB4ATUBBTUBA3CTUBA1BTUBA4A | |
| SCHEMBL4180973 | 0.79 | TUBB4A (0.56) | TUBB4ATUBBTUBA3CTUBA1BTUBA4A | |
| SCHEMBL4180977 | 0.76 | ACHE (0.30) | ACHE | |
| SCHEMBL4171128 | 0.74 | MERTK (0.31) | — | |
| SCHEMBL6694090 | 0.63 | PRKCI (0.41) | — | |
| SCHEMBL950266 | 0.61 | ALDH1A1 (0.44) | — | |
| SCHEMBL18074948 | 0.61 | PRKCI (0.39) | — | |
| SCHEMBL12699417 | 0.61 | PLAU (0.42) | — | |
| SCHEMBL18074982 | 0.58 | SLC2A1 (0.42) | — |
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-2005004818-A2 | HETEROCYCLIC COMPOUNDS AND THEIR USE AS ANTICANCER AGENTS | IMCLONE SYSTEMS INCORPORATED (US) | 2005-01-20 | — | — | WO | disclosed |