Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASR | P41180 | 11/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9811211 | 0.90 | CASR (0.44) | CASRALDH1A1ALOX15TSHRCASP1 | |
| SCHEMBL11020676 | 0.81 | PPARA (0.52) | NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL9811016 | 0.79 | ALDH1A1 (0.46) | CASRALDH1A1ALOX15TSHRCASP1 | |
| SCHEMBL11021772 | 0.73 | RAB9A (0.38) | ALDH1A1LMNAHPGDCYP2C19NPC1 | |
| SCHEMBL11018394 | 0.73 | SMN1; SMN2 (0.45) | LMNACYP1A2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL9811014 | 0.73 | CASR (0.47) | CASRALDH1A1ALOX15TSHRCASP1 | |
| SCHEMBL29031683 | 0.72 | CASR (0.54) | CASRALDH1A1LMNAL3MBTL1NPC1 | |
| SCHEMBL11020673 | 0.71 | PPARA (0.48) | — | |
| SCHEMBL10573419 | 0.71 | CASR (0.54) | CASRALDH1A1LMNAL3MBTL1CYP1A2 | |
| SCHEMBL24496148 | 0.71 | CASR (0.53) | CASRALDH1A1ALOX15TSHRCASP1 |
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 |