Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASR | P41180 | 11/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.33 |
| ▸ | P2RY6 | Q15077 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9811099 | 0.92 | ALDH1A1 (0.38) | CASRALDH1A1KMT2AGAAHPGD | |
| SCHEMBL9811129 | 0.92 | L3MBTL1 (0.37) | CASRALDH1A1KMT2AGAAHPGD | |
| SCHEMBL9811004 | 0.92 | L3MBTL1 (0.37) | CASRALDH1A1KMT2AGAAHPGD | |
| SCHEMBL9811107 | 0.87 | L3MBTL1 (0.38) | CASRALDH1A1KMT2AGAAHPGD | |
| SCHEMBL9811006 | 0.83 | NPC1 (0.38) | CASRALDH1A1KMT2AGAAKDM4E | |
| SCHEMBL9811133 | 0.83 | NPC1 (0.38) | CASRALDH1A1KMT2AGAAKDM4E | |
| SCHEMBL9811109 | 0.79 | NPC1 (0.39) | CASRALDH1A1KMT2AGAAKDM4E | |
| SCHEMBL9810998 | 0.78 | SMN1; SMN2 (0.39) | MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL11020317 | 0.78 | PPARA (0.39) | KMT2AMAPTNPC1RAB9A | |
| SCHEMBL9810995 | 0.76 | CASR (0.40) | CASRALDH1A1KMT2AGAAHPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-0161219-B1 | HETEROCYCLIC MERCAPTOCARBOXYLIC-ACID ESTERS AND ANHYDRIDES AS CORROSION INHIBITING AGENTS | CIBA-GEIGY AG (CH) | 1991-06-12 | — | — | EP | disclosed |
| EP-0161219-A2 | Heterocyclic mercaptocarboxylic-acid esters and anhydrides as corrosion inhibiting agents | CIBA-GEIGY AG (CH) | 1985-11-13 | — | — | EP | disclosed |