Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.79 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.79 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.79 |
| ▸ | RAF1 | P04049 | 1/20 | 0.79 |
| ▸ | CDK1 | P06493 | 1/20 | 0.79 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.79 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.59 |
| ▸ | TUBB | P07437 | 2/20 | 0.59 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.59 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.59 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.59 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.59 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.59 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.59 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.59 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.59 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.59 |
| ▸ | TUBA1C | Q9BQE3 | 2/20 | 0.59 |
| ▸ | TUBB6 | Q9BUF5 | 2/20 | 0.59 |
| ▸ | TUBB2B | Q9BVA1 | 2/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL30743914 | 0.95 | CYP1A2 (0.87) | CYP1A2CYP2C9CYP2C19RAF1CDK1 | |
| SCHEMBL80052 | 0.90 | CYP1A2 (0.79) | CYP1A2CYP2C9CYP2C19RAF1CDK1 | |
| SCHEMBL79853 | 0.90 | CYP1A2 (0.79) | CYP1A2CYP2C9CYP2C19RAF1CDK1 | |
| SCHEMBL10207768 | 0.88 | CYP1A2 (0.77) | CYP1A2CYP2C9CYP2C19RAF1CDK1 | |
| SCHEMBL79693 | 0.88 | CYP1A2 (0.77) | CYP1A2CYP2C9CYP2C19RAF1CDK1 | |
| SCHEMBL79295 | 0.88 | CYP1A2 (0.77) | CYP1A2CYP2C9CYP2C19RAF1CDK1 | |
| Plinabulin SCHEMBL79095 | 0.88 | CYP1A2 (1.00) | CYP1A2CYP2C9CYP2C19RAF1CDK1 | |
| Plinabulin SCHEMBL21050030 | 0.88 | CYP1A2 (1.00) | CYP1A2CYP2C9CYP2C19RAF1CDK1 | |
| Plinabulin SCHEMBL29033820 | 0.88 | CYP1A2 (1.00) | CYP1A2CYP2C9CYP2C19RAF1CDK1 | |
| Plinabulin SCHEMBL29216847 | 0.88 | CYP1A2 (1.00) | CYP1A2CYP2C9CYP2C19RAF1CDK1 |
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-2007035841-A1 | ANALOGS OF DEHYDROPHENYLAHISTINS AND THEIR THERAPEUTIC USE | NEREUS PHARMACEUTICALS, INC. (US) | 2007-03-29 | — | — | WO | disclosed |