Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5597698 | 0.75 | — | — | |
| SCHEMBL9419514 | 0.72 | ALDH1A1 (0.46) | ALDH1A1TSHRKDM4E | |
| SCHEMBL11575734 | 0.70 | ALDH1A1 (0.34) | ALDH1A1KDM4E | |
| SCHEMBL11575377 | 0.70 | ALDH1A1 (0.33) | ALDH1A1KDM4E | |
| SCHEMBL10484218 | 0.69 | ALDH1A1 (0.41) | ALDH1A1TSHRKDM4E | |
| SCHEMBL10484037 | 0.69 | ALDH1A1 (0.41) | ALDH1A1TSHRKDM4E | |
| SCHEMBL10484236 | 0.69 | ALDH1A1 (0.41) | ALDH1A1TSHRKDM4E | |
| SCHEMBL10899437 | 0.69 | — | — | |
| SCHEMBL11574922 | 0.68 | ALDH1A1 (0.42) | ALDH1A1TSHR | |
| SCHEMBL9460690 | 0.68 | ALDH1A1 (0.38) | ALDH1A1TSHRKDM4E |
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-4113444-A | HALONITRO ALCOHOLS | GULF RESEARCH & DEVELOPMENT CO. (US) | 1978-09-12 | — | — | US | disclosed |