Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.39 |
| ▸ | TUBB | P07437 | 1/20 | 0.39 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.39 |
| ▸ | TUBA4A | P68366 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8170350 | 0.81 | MAPK1 (0.48) | MAPK1CYP1A2CYP3A4CYP2D6MEN1 | |
| SCHEMBL10733451 | 0.73 | MAPK1 (0.44) | MAPK1CYP1A2CYP3A4CYP2D6MEN1 | |
| SCHEMBL10729951 | 0.69 | MAPK1 (0.50) | MAPK1CYP1A2CYP3A4CYP2D6MEN1 | |
| SCHEMBL10731007 | 0.69 | MAPK1 (0.47) | MAPK1CYP1A2CYP3A4CYP2D6MEN1 | |
| SCHEMBL10730117 | 0.68 | MAPK1 (0.49) | MAPK1CYP1A2CYP3A4CYP2D6MEN1 | |
| SCHEMBL19537683 | 0.67 | MAPK1 (0.57) | MAPK1CYP1A2CYP3A4CYP2D6MEN1 | |
| SCHEMBL11266316 | 0.66 | MAPK1 (0.53) | MAPK1CYP1A2CYP3A4CYP2D6MEN1 | |
| SCHEMBL2827619 | 0.66 | LMNA (0.59) | MAPK1CYP1A2CYP3A4CYP2D6MEN1 | |
| SCHEMBL2829838 | 0.66 | LMNA (0.59) | MAPK1CYP1A2CYP3A4CYP2D6MEN1 | |
| SCHEMBL4847727 | 0.66 | ALDH1A1 (0.41) | MAPK1CYP1A2CYP3A4CYP2D6MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1710241-B1 | Intermediate compounds for the preparation of trans-5-chloro-2-methyl-2,3,3a,12b-tetrahydro-1h-dibenz[2,3:6,7]oxepino[4,5-c]pyrrole | ORGANON NV (NL) | 2009-11-04 | — | — | EP | claimed |