Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.75 |
| ▸ | TSHR | P16473 | 3/20 | 0.75 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL128924 | 0.87 | — | — | |
| SCHEMBL4242070 | 0.87 | TSHR (1.00) | ALDH1A1TSHRTDP1TP53THRB | |
| Hydrogen Sulfide SCHEMBL23406552 | 0.84 | TSHR (0.94) | ALDH1A1TSHRTDP1TP53THRB | |
| SCHEMBL30074426 | 0.84 | — | — | |
| Hydrogen Sulfide SCHEMBL23406579 | 0.84 | TSHR (0.94) | ALDH1A1TSHRTDP1TP53THRB | |
| Ethylene SCHEMBL27441901 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL5148304 | 0.84 | — | — | |
| Nitrogen SCHEMBL27994081 | 0.81 | — | — | |
| Cyanide SCHEMBL28989955 | 0.79 | — | — | |
| SCHEMBL9635596 | 0.77 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5741940-A | Process for the production and purification of vinyl carbonyls | EASTMAN CHEMICAL COMPANY (US) | 1998-04-21 | — | — | US | disclosed |
| US-5637774-A | Process for the production of vinyl carbonyls | EASTMAN CHEMICAL COMPANY (US) | 1997-06-10 | — | — | US | disclosed |