Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TUBB4A | P04350 | 4/20 | 0.45 |
| ▸ | TUBB | P07437 | 4/20 | 0.45 |
| ▸ | TUBA3C | P0DPH7 | 4/20 | 0.45 |
| ▸ | TUBA1B | P68363 | 4/20 | 0.45 |
| ▸ | TUBA4A | P68366 | 4/20 | 0.45 |
| ▸ | TUBB4B | P68371 | 4/20 | 0.45 |
| ▸ | TUBB3 | Q13509 | 4/20 | 0.45 |
| ▸ | TUBB2A | Q13885 | 4/20 | 0.45 |
| ▸ | TUBB8 | Q3ZCM7 | 4/20 | 0.45 |
| ▸ | TUBA3E | Q6PEY2 | 4/20 | 0.45 |
| ▸ | TUBA1A | Q71U36 | 4/20 | 0.45 |
| ▸ | TUBA1C | Q9BQE3 | 4/20 | 0.45 |
| ▸ | TUBB6 | Q9BUF5 | 4/20 | 0.45 |
| ▸ | TUBB2B | Q9BVA1 | 4/20 | 0.45 |
| ▸ | TUBB1 | Q9H4B7 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4735635 | 0.82 | SMN1; SMN2 (0.43) | ALDH1A1MAPK1SMN1; SMN2CYP2C19POLB | |
| SCHEMBL11435411 | 0.81 | TUBB4A (0.54) | TUBB4ATUBBTUBA3CTUBA1BTUBA4A | |
| SCHEMBL4735459 | 0.76 | TUBB4A (0.49) | TUBB4ATUBBTUBA3CTUBA1BTUBA4A | |
| SCHEMBL38665425 | 0.76 | HPGD (0.61) | TUBB4ATUBBTUBA3CTUBA1BTUBA4A | |
| SCHEMBL3931846 | 0.76 | ALDH1A1 (0.40) | ALDH1A1MAPK1SMN1; SMN2CYP2C19POLB | |
| SCHEMBL31368540 | 0.75 | ALDH1A1 (0.52) | ALDH1A1MAPK1SMN1; SMN2KDM4EPOLB | |
| SCHEMBL1179017 | 0.75 | ALDH1A1 (0.52) | ALDH1A1MAPK1SMN1; SMN2KDM4EPOLB | |
| SCHEMBL29561847 | 0.72 | SMN1; SMN2 (0.46) | ALDH1A1MAPK1SMN1; SMN2POLBGPBAR1 | |
| SCHEMBL4928556 | 0.72 | SMN1; SMN2 (0.46) | ALDH1A1MAPK1SMN1; SMN2POLBGPBAR1 | |
| SCHEMBL501900 | 0.72 | SMN1; SMN2 (0.55) | ALDH1A1MAPK1SMN1; SMN2POLBGPBAR1 |
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-2008070014-A2 | BIARYL KETONE-SUBSTITUTED PIPERIDINES | NEUROGEN CORPORATION (US) | 2008-06-12 | — | — | WO | disclosed |
| WO-2008070014-A2 | BIARYL KETONE-SUBSTITUTED PIPERIDINES | NEUROGEN CORPORATION (US) | 2008-06-12 | — | — | WO | disclosed |