Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 4/20 | 0.50 |
| ▸ | 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 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6965529 | 0.81 | CYP2A6 (0.55) | CYP2A6TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL6965535 | 0.81 | CYP2A6 (0.55) | CYP2A6TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL9603135 | 0.78 | CYP2A6 (0.55) | CYP2A6TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL7283628 | 0.78 | CYP2A6 (0.55) | CYP2A6TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL10693435 | 0.78 | CYP2A6 (0.55) | CYP2A6TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL23804860 | 0.77 | CYP2A6 (0.54) | CYP2A6TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL23804858 | 0.77 | CYP2A6 (0.54) | CYP2A6TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL12884251 | 0.75 | TUBB4A (0.62) | CYP2A6TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL12884253 | 0.75 | CYP2A6 (0.64) | CYP2A6TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL3080069 | 0.73 | CYP2A6 (0.62) | CYP2A6TUBB4ATUBBTUBA3CTUBA1B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0279263-B1 | INDOLE, BENZOFURAN, BENZOTHIOPHENE CONTAINING LIPOXYGENASE INHIBITING COMPOUNDS | ABBOTT LABORATORIES (US) | 1993-08-04 | — | — | EP | disclosed |
| US-4873259-A | Indole, benzofuran, benzothiophene containing lipoxygenase inhibiting compounds | ABBOTT LABORATORIES (US) | 1989-10-10 | — | — | US | disclosed |
| EP-0279263-A2 | Indole, benzofuran, benzothiophene containing lipoxygenase inhibiting compounds | ABBOTT LABORATORIES (US) | 1988-08-24 | — | — | EP | disclosed |