Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | THPO | P40225 | 1/20 | 0.43 |
| ▸ | MTOR | P42345 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.43 |
| ▸ | TUBB | P07437 | 2/20 | 0.43 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.43 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.43 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.43 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.43 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.43 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.43 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.43 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.43 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.43 |
| ▸ | TUBA1C | Q9BQE3 | 2/20 | 0.43 |
| ▸ | TUBB6 | Q9BUF5 | 2/20 | 0.43 |
| ▸ | TUBB2B | Q9BVA1 | 2/20 | 0.43 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9128080 | 0.98 | NPC1 (0.44) | CYP3A4CYP2D6THPOMTORNPC1 | |
| SCHEMBL27316933 | 0.93 | TUBB1 (0.45) | CYP3A4NPC1TUBB4ATUBBTUBA3C | |
| SCHEMBL11044739 | 0.82 | TUBB1 (0.46) | CYP3A4NPC1TUBB4ATUBBTUBA3C | |
| SCHEMBL8934082 | 0.82 | TUBB1 (0.50) | CYP3A4NPC1TUBB4ATUBBTUBA3C | |
| SCHEMBL9092441 | 0.81 | CA12 (0.52) | PLAUMAPTCA9 | |
| SCHEMBL28900604 | 0.80 | TUBB1 (0.47) | CYP3A4NPC1TUBB4ATUBBTUBA3C | |
| SCHEMBL9041895 | 0.79 | TUBB1 (0.46) | CYP3A4NPC1TUBB4ATUBBTUBA3C | |
| SCHEMBL7391987 | 0.79 | ALDH1A1 (0.48) | NPC1 | |
| SCHEMBL7392269 | 0.79 | CA12 (0.53) | ACHEPLAUMAPTCA9 | |
| SCHEMBL12691913 | 0.78 | PLA2G2A (0.47) | CYP2D6ACHEPLAU |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996015672-A1 | FUNGICIDAL COMPOSITION | ZENECA LIMITED (GB) | 1996-05-30 | — | — | WO | disclosed |
| WO-1996015671-A1 | HERBICIDES | ZENECA LIMITED (GB) | 1996-05-30 | — | — | WO | disclosed |