Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.40 |
| ▸ | PHGDH | O43175 | 1/20 | 0.40 |
| ▸ | MGLL | Q99685 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL130399 | 0.97 | ALDH1A1 (0.58) | ALDH1A1KMT2AL3MBTL1MEN1MAPT | |
| SCHEMBL28081269 | 0.95 | ALDH1A1 (0.56) | ALDH1A1KMT2AL3MBTL1MEN1MAPT | |
| SCHEMBL27992541 | 0.95 | ALDH1A1 (0.56) | ALDH1A1KMT2AL3MBTL1MEN1MAPT | |
| SCHEMBL29263939 | 0.95 | ALDH1A1 (0.56) | ALDH1A1KMT2AL3MBTL1MEN1MAPT | |
| SCHEMBL27992536 | 0.95 | ALDH1A1 (0.56) | ALDH1A1KMT2AL3MBTL1MEN1MAPT | |
| SCHEMBL28010980 | 0.95 | ALDH1A1 (0.56) | ALDH1A1KMT2AL3MBTL1MEN1MAPT | |
| Zinc Ion SCHEMBL2982383 | 0.93 | ALDH1A1 (0.54) | ALDH1A1KMT2AL3MBTL1MEN1MAPT | |
| SCHEMBL14354422 | 0.85 | ALDH1A1 (0.47) | ALDH1A1KMT2AL3MBTL1MEN1MAPT | |
| Malonic Acid SCHEMBL14742537 | 0.83 | NPSR1 (0.48) | ALDH1A1KMT2AL3MBTL1MEN1MAPT | |
| SCHEMBL13007133 | 0.82 | ALDH1A1 (0.48) | ALDH1A1KMT2AL3MBTL1MEN1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-103237782-B | Method for inhibiting unwanted free-radical polymerization of acrylic acid present in liquid phase P | BASF SE (DE) | 2016-01-13 | — | — | CN | disclosed |