Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.53 |
| ▸ | TUBB1 | Q9H4B7 | 15/20 | 0.53 |
| ▸ | TUBB4A | P04350 | 10/20 | 0.53 |
| ▸ | TUBB | P07437 | 10/20 | 0.53 |
| ▸ | TUBA3C | P0DPH7 | 10/20 | 0.53 |
| ▸ | TUBA1B | P68363 | 10/20 | 0.53 |
| ▸ | TUBA4A | P68366 | 10/20 | 0.53 |
| ▸ | TUBB4B | P68371 | 10/20 | 0.53 |
| ▸ | TUBB3 | Q13509 | 10/20 | 0.53 |
| ▸ | TUBB2A | Q13885 | 10/20 | 0.53 |
| ▸ | TUBB8 | Q3ZCM7 | 10/20 | 0.53 |
| ▸ | TUBA3E | Q6PEY2 | 10/20 | 0.53 |
| ▸ | TUBA1A | Q71U36 | 10/20 | 0.53 |
| ▸ | TUBA1C | Q9BQE3 | 10/20 | 0.53 |
| ▸ | TUBB6 | Q9BUF5 | 10/20 | 0.53 |
| ▸ | TUBB2B | Q9BVA1 | 10/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL9129548 | 1.00 | CYP1A1 (0.53) | CYP1A1CYP1A2CYP1B1TUBB1TUBB4A | |
| SCHEMBL8627361 | 0.90 | TUBB1 (0.50) | CYP1A1CYP1A2CYP1B1TUBB1TUBB4A | |
| SCHEMBL4765514 | 0.90 | TUBB1 (0.50) | CYP1A1CYP1A2CYP1B1TUBB1TUBB4A | |
| SCHEMBL4765528 | 0.90 | TUBB1 (0.50) | CYP1A1CYP1A2CYP1B1TUBB1TUBB4A | |
| SCHEMBL4450715 | 0.85 | CYP1A1 (0.56) | CYP1A1CYP1A2CYP1B1TUBB1TUBB4A | |
| SCHEMBL4450716 | 0.85 | CYP1A1 (0.56) | CYP1A1CYP1A2CYP1B1TUBB1TUBB4A | |
| SCHEMBL29565593 | 0.85 | CYP1A1 (0.56) | CYP1A1CYP1A2CYP1B1TUBB1TUBB4A | |
| SCHEMBL9763608 | 0.82 | TUBB1 (0.55) | CYP1A1CYP1A2CYP1B1TUBB1TUBB4A | |
| SCHEMBL5691704 | 0.82 | CYP1A1 (0.53) | CYP1A1CYP1A2CYP1B1TUBB1TUBB4A | |
| SCHEMBL9763615 | 0.82 | TUBB1 (0.55) | CYP1A1CYP1A2CYP1B1TUBB1TUBB4A |
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-0541798-B1 | NEW DIAMINE COMPOUND AND BRAIN PROTECTING AGENT CONTAINING THE SAME | KOWA CO (JP) | 1995-11-29 | — | — | EP | disclosed |
| US-5389630-A | Diamine compound and brain protecting agent containing the same | KOWA CO., LTD. (JP) | 1995-02-14 | — | — | US | disclosed |
| EP-0541798-A1 | NEW DIAMINE COMPOUND AND BRAIN PROTECTING AGENT CONTAINING THE SAME | Kowa Company Ltd. (JP) | 1993-05-19 | — | — | EP | disclosed |