Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 3/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | FYN | P06241 | 1/20 | 0.40 |
| ▸ | TUBB1 | Q9H4B7 | 4/20 | 0.40 |
| ▸ | TUBB4A | P04350 | 3/20 | 0.40 |
| ▸ | TUBB | P07437 | 3/20 | 0.40 |
| ▸ | TUBA3C | P0DPH7 | 3/20 | 0.40 |
| ▸ | TUBA1B | P68363 | 3/20 | 0.40 |
| ▸ | TUBA4A | P68366 | 3/20 | 0.40 |
| ▸ | TUBB4B | P68371 | 3/20 | 0.40 |
| ▸ | TUBB3 | Q13509 | 3/20 | 0.40 |
| ▸ | TUBB2A | Q13885 | 3/20 | 0.40 |
| ▸ | TUBB8 | Q3ZCM7 | 3/20 | 0.40 |
| ▸ | TUBA3E | Q6PEY2 | 3/20 | 0.40 |
| ▸ | TUBA1A | Q71U36 | 3/20 | 0.40 |
| ▸ | TUBA1C | Q9BQE3 | 3/20 | 0.40 |
| ▸ | TUBB6 | Q9BUF5 | 3/20 | 0.40 |
| ▸ | TUBB2B | Q9BVA1 | 3/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9307579 | 0.79 | ADRA1A (0.58) | ADRA2AADRA1ACYP2D6CYP1A1CYP1A2 | |
| SCHEMBL17304630 | 0.74 | TNFRSF1A (0.50) | ERN1CYP2D6TUBB1TUBB4ATUBB | |
| SCHEMBL17320121 | 0.73 | ERN1 (0.59) | ERN1FYNTUBB1TUBB4ATUBB | |
| SCHEMBL17304629 | 0.71 | APP (0.51) | TUBB1TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL24148928 | 0.71 | TUBB4A (0.47) | ERN1TUBB1TUBB4ATUBBTUBA3C | |
| SCHEMBL17371457 | 0.71 | TUBB4A (0.47) | ERN1TUBB1TUBB4ATUBBTUBA3C | |
| SCHEMBL13952628 | 0.70 | TUBB4A (0.55) | CYP2D6FYNTUBB1TUBB4ATUBB | |
| SCHEMBL27918739 | 0.70 | FYN (0.48) | CYP2D6FYNTUBB1TUBB4ATUBB | |
| SCHEMBL20921416 | 0.67 | AKR1C3 (0.44) | MAPK1 | |
| SCHEMBL16952192 | 0.66 | CYP2D6 (0.54) | ADRA2AADRA1ACYP2D6CYP1A1CYP1A2 |
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-2952501-A2 | Anti-cancer dibenzocycloheptane derivatives and a catalytic method for dibenzocycloheptane synthesis and allocolchicinoid synthesis | University of Windsor (CA) | 2015-12-09 | — | — | EP | disclosed |