Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.34 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | ALPL | P05186 | 2/20 | 0.30 |
| ▸ | ALPI | P09923 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11785306 | 1.00 | ALDH1A1 (0.34) | ALDH1A1KDM5BRAD51PKMLMNA | |
| SCHEMBL11780619 | 0.81 | LMNA (0.39) | ALDH1A1KDM5BLMNAALPLALPI | |
| SCHEMBL25153650 | 0.80 | ALDH1A1 (0.40) | ALDH1A1KDM5BRAD51PKMLMNA | |
| SCHEMBL11784400 | 0.76 | ALDH1A1 (0.39) | ALDH1A1KDM5BPKMLMNAALPL | |
| SCHEMBL2608960 | 0.75 | POLB (0.41) | ALDH1A1KDM5BPKM | |
| SCHEMBL11783018 | 0.73 | ALDH1A1 (0.34) | ALDH1A1KDM5BPKMLMNAAR | |
| SCHEMBL27372069 | 0.72 | ADORA2B (0.39) | ALDH1A1KDM5BPKM | |
| SCHEMBL11785413 | 0.72 | SMN1; SMN2 (0.42) | ALDH1A1LMNAALPLALPI | |
| SCHEMBL11782878 | 0.72 | SMN1; SMN2 (0.42) | ALDH1A1LMNAALPLALPI | |
| SCHEMBL11783002 | 0.72 | SMN1; SMN2 (0.42) | ALDH1A1LMNAALPLALPI |
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-3981715-A | 2,3,5-Substituted-6-trifluoromethyl-1,3-diazin-4-ones herbicides | AMERICAN CYANAMID COMPANY (US) | 1976-09-21 | — | — | US | disclosed |