Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.51 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.51 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | GLRA1 | P23415 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29153308 | 0.89 | ALDH1A1 (0.50) | ALDH1A1KMT2ASLC1A3SLC1A2SLC1A1 | |
| SCHEMBL1231110 | 0.83 | SLC1A1 (0.59) | ALDH1A1KMT2ASLC1A3SLC1A2SLC1A1 | |
| SCHEMBL27276612 | 0.82 | ALDH1A1 (0.55) | ALDH1A1KMT2ASLC1A3SLC1A2SLC1A1 | |
| Hydrochloric Acid SCHEMBL9760378 | 0.82 | SLC1A1 (0.58) | ALDH1A1KMT2ASLC1A3SLC1A2SLC1A1 | |
| SCHEMBL5169494 | 0.81 | ALDH1A1 (0.53) | ALDH1A1KMT2ASLC1A3SLC1A2SLC1A1 | |
| SCHEMBL839677 | 0.81 | ALDH1A1 (0.53) | ALDH1A1KMT2ASLC1A3SLC1A2SLC1A1 | |
| SCHEMBL5168366 | 0.81 | ALDH1A1 (0.53) | ALDH1A1KMT2ASLC1A3SLC1A2SLC1A1 | |
| SCHEMBL6567345 | 0.80 | SLC1A3 (0.56) | ALDH1A1KMT2ASLC1A3SLC1A2SLC1A1 | |
| SCHEMBL28656889 | 0.79 | ALDH1A1 (0.52) | ALDH1A1KMT2ASLC1A3SLC1A2SLC1A1 | |
| SCHEMBL8870449 | 0.79 | ALDH1A1 (0.52) | ALDH1A1KMT2ASLC1A3SLC1A2SLC1A1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0317492-B1 | Substituted dicarboxylic acids-bis(3,5-dicarbamoyl-2,4,6-triiodo-anilides), process for their preparation and X-ray contrast agents containing them | SCHERING AG (DE) | 1994-06-01 | — | — | EP | disclosed |
| EP-0308364-B1 | Dicarboxylic acid-bis(3,5-dicarbamoyl-2-4-6-triiodanilides), process for their preparation and X-ray contrast agents containing them | SCHERING AG (DE) | 1993-11-10 | — | — | EP | disclosed |
| US-5073362-A | DICARBOXYLIC ACID-BIS(3,5-DICARBAMOYL-2,4,6-TRIIODOANILIDES) AND X-RAY CONTRAST MEDIA CONTAINING THEM | SCHERING AKTIENGESELLSCHAFT (DE) | 1991-12-17 | — | — | US | disclosed |
| US-5004835-A | Substituted dicarboxylic acid-bis(3,5-dicarbamoyl-2,4,6-triiodoanilides), process for their production as well as X-ray contrast media containing them | SCHERING AKTIENGESELLSCHAFT (DE) | 1991-04-02 | — | — | US | disclosed |
| EP-0308364-A2 | Dicarboxylic acid-bis(3,5-dicarbamoyl-2-4-6-triiodanilides), process for their preparation and X-ray contrast agents containing them | SCHERING AKTIENGESELLSCHAFT (DE) | 1989-03-22 | — | — | EP | disclosed |