Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL20750966 | 0.85 | — | — | |
| SCHEMBL22883643 | 0.83 | TRPA1 (0.42) | TRPA1EPHX2 | |
| SCHEMBL25148544 | 0.72 | PAOX (0.44) | TRPA1EPHX2 | |
| SCHEMBL20088725 | 0.72 | EPHX2 (0.33) | TRPA1EPHX2 | |
| SCHEMBL22743713 | 0.70 | ALDH1A1 (0.31) | — | |
| SCHEMBL18830537 | 0.69 | EPHX2 (0.48) | TRPA1EPHX2 | |
| SCHEMBL22297115 | 0.68 | ALDH1A1 (0.55) | — | |
| SCHEMBL20750766 | 0.68 | ALDH1A1 (0.55) | — | |
| SCHEMBL10158622 | 0.68 | ALDH1A1 (0.55) | — | |
| SCHEMBL18807826 | 0.68 | ALDH1A1 (0.55) | — |
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-3099681-B1 | CYTOTOXIC TUBULYSIN COMPOUNDS AND CONJUGATES THEREOF | TUBE PHARMACEUTICALS GMBH (AT) | 2020-12-09 | — | — | EP | disclosed |