Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 4/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 2/20 | 0.45 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.45 |
| ▸ | TUBB | P07437 | 1/20 | 0.45 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.45 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.45 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.45 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.45 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.45 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.45 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.45 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.45 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.45 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.45 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.45 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.45 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2013244 | 0.83 | MAOA (0.61) | MAOAHDAC1MAOBTUBB4ATUBB | |
| SCHEMBL272553 | 0.82 | MAOA (0.64) | MAOAHDAC1MAOBTUBB4ATUBB | |
| SCHEMBL1834224 | 0.80 | MAOA (0.61) | MAOAALDH1A1HDAC1TUBB4ATUBB | |
| SCHEMBL17008380 | 0.80 | MAOA (0.61) | MAOAHDAC1TUBB4ATUBBTUBA3C | |
| SCHEMBL29918021 | 0.80 | MAOA (0.55) | MAOAALDH1A1MAOBGAARAD51 | |
| SCHEMBL22418879 | 0.80 | MAOA (0.55) | MAOAALDH1A1MAOBGAARAD51 | |
| SCHEMBL29783647 | 0.79 | MAOA (0.60) | MAOAHDAC1TUBB4ATUBBTUBA3C | |
| SCHEMBL27623659 | 0.78 | MAOA (0.59) | MAOAHDAC1TUBB4ATUBBTUBA3C | |
| SCHEMBL30621292 | 0.78 | MAOA (0.59) | MAOAHDAC1TUBB4ATUBBTUBA3C | |
| SCHEMBL26500691 | 0.77 | MAOA (0.58) | MAOAHDAC1MAOBTUBB4ATUBB |
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 |
|---|---|---|---|---|---|---|---|
| EP-2637649-A2 | COMPOUNDS AND METHODS FOR TREATING PAIN | Akron Molecules GmbH (AT) | 2013-09-18 | — | — | EP | disclosed |
| WO-2012062925-A2 | COMPOUNDS AND METHODS FOR TREATING PAIN | AKRON MOLECULES GMBH (AT) | 2012-05-18 | — | — | WO | disclosed |