Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 4/20 | 0.64 |
| ▸ | GSK3B | P49841 | 1/20 | 0.46 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.45 |
| ▸ | TUBB | P07437 | 2/20 | 0.45 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.45 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.45 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.45 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.45 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.45 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.45 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.45 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.45 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.45 |
| ▸ | TUBA1C | Q9BQE3 | 2/20 | 0.45 |
| ▸ | TUBB6 | Q9BUF5 | 2/20 | 0.45 |
| ▸ | TUBB2B | Q9BVA1 | 2/20 | 0.45 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.45 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.44 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.44 |
| ▸ | MGLL | Q99685 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2902480 | 0.80 | CYP2A6 (0.67) | CYP2A6GSK3BTUBB4ATUBBTUBA3C | |
| SCHEMBL1567141 | 0.78 | CYP2A6 (0.64) | CYP2A6GSK3BTUBB4ATUBBTUBA3C | |
| SCHEMBL12884253 | 0.78 | CYP2A6 (0.64) | CYP2A6GSK3BTUBB4ATUBBTUBA3C | |
| SCHEMBL27556684 | 0.78 | CYP2A6 (0.64) | CYP2A6GSK3BTUBB4ATUBBTUBA3C | |
| SCHEMBL7079637 | 0.78 | CYP2A6 (0.64) | CYP2A6GSK3BTUBB4ATUBBTUBA3C | |
| SCHEMBL7416778 | 0.78 | CYP2A6 (0.64) | CYP2A6GSK3BTUBB4ATUBBTUBA3C | |
| SCHEMBL1567214 | 0.78 | CYP2A6 (0.64) | CYP2A6GSK3BTUBB4ATUBBTUBA3C | |
| SCHEMBL29629031 | 0.78 | CYP2A6 (1.00) | CYP2A6GSK3BTUBB4ATUBBTUBA3C | |
| SCHEMBL56884 | 0.78 | CYP2A6 (1.00) | CYP2A6GSK3BTUBB4ATUBBTUBA3C | |
| SCHEMBL27645156 | 0.78 | CYP2A6 (0.64) | CYP2A6GSK3BTUBB4ATUBBTUBA3C |
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 |
|---|---|---|---|---|---|---|---|
| US-5547980-A | ANTIALLERGENS, BRONCHODILATOR | BOEHRINGER MANNHEIM GMBH (DE) | 1996-08-20 | — | — | US | disclosed |