Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.56 |
| ▸ | TSHR | P16473 | 3/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.39 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3204404 | 0.83 | ALDH1A1 (0.39) | ALDH1A1TSHRTDP1LMNAHSD17B10 | |
| Butane SCHEMBL28203399 | 0.76 | ALDH1A1 (0.71) | ALDH1A1TSHRTDP1LMNAHSD17B10 | |
| Alcohol SCHEMBL1534284 | 0.76 | ALDH1A1 (0.71) | ALDH1A1TSHRTDP1LMNAHSD17B10 | |
| Butanone SCHEMBL28280158 | 0.76 | ALDH1A1 (0.71) | ALDH1A1TSHRTDP1LMNAHSD17B10 | |
| SCHEMBL1331774 | 0.73 | — | — | |
| SCHEMBL523 | 0.73 | — | — | |
| SCHEMBL1330344 | 0.73 | — | — | |
| SCHEMBL9866292 | 0.73 | — | — | |
| SCHEMBL1331977 | 0.73 | — | — | |
| SCHEMBL5305593 | 0.73 | ALDH1A1 (1.00) | ALDH1A1TSHRTDP1LMNAHSD17B10 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0640067-A4 | IMPROVED SYNTHESIS OF IOVERSOL. | MALLINCKRODT MEDICAL INC (US) | 1995-05-31 | — | — | EP | disclosed |
| EP-0640067-A1 | IMPROVED SYNTHESIS OF IOVERSOL. | MALLINCKRODT MEDICAL INC (US) | 1995-03-01 | — | — | EP | disclosed |
| WO-1993023365-A1 | IMPROVED SYNTHESIS OF IOVERSOL | MALLINCKRODT MEDICAL, INC. (US) | 1993-11-25 | — | — | WO | disclosed |