Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7988202 | 0.84 | ALDH1A1 (0.46) | KDM4EALDH1A1 | |
| SCHEMBL10054032 | 0.75 | USP2 (0.37) | CYP3A4ALDH1A1 | |
| SCHEMBL472055 | 0.71 | NPC1 (0.37) | CYP3A4ATMALDH1A1 | |
| SCHEMBL6619829 | 0.71 | CA2 (0.36) | ALDH1A1 | |
| SCHEMBL16234754 | 0.66 | TRPA1 (0.33) | ALDH1A1 | |
| SCHEMBL1987675 | 0.64 | CYP3A4 (0.71) | CYP3A4ATMKDM4EALDH1A1 | |
| SCHEMBL10041191 | 0.64 | NPC1 (0.50) | ATMALDH1A1 | |
| SCHEMBL95232 | 0.62 | ATM (0.52) | CYP3A4ATMKDM4EALDH1A1 | |
| SCHEMBL14620454 | 0.60 | KDM4E (0.49) | CYP3A4KDM4EALDH1A1 | |
| SCHEMBL721179 | 0.59 | ALDH1A1 (0.65) | KDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6355634-B1 | OXIME DERIVATIVES | BAYER AKTIENGESELLSCHAFT (DE) | 2002-03-12 | — | — | US | claimed |