Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 5/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.42 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.42 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10762434 | 0.87 | ALDH1A1 (0.36) | ALDH1A1HPGDCYP3A4CA2L3MBTL1 | |
| SCHEMBL15277982 | 0.85 | ALDH1A1 (0.59) | ALDH1A1HPGDCYP3A4CA2L3MBTL1 | |
| SCHEMBL19439110 | 0.83 | HTT (0.55) | ALDH1A1HPGDCYP3A4L3MBTL1LMNA | |
| SCHEMBL9811037 | 0.83 | ALDH1A1 (0.55) | ALDH1A1HPGDLMNAPOLBTSHR | |
| SCHEMBL10359354 | 0.82 | ALDH1A1 (0.48) | ALDH1A1HPGDL3MBTL1LMNAPOLB | |
| SCHEMBL10349329 | 0.78 | ALDH1A1 (0.45) | ALDH1A1HPGDCYP3A4CA2L3MBTL1 | |
| SCHEMBL9811152 | 0.76 | POLB (0.46) | ALDH1A1HPGDLMNAPOLBTSHR | |
| SCHEMBL21022861 | 0.74 | HTT (0.54) | ALDH1A1HPGDL3MBTL1LMNAPOLB | |
| SCHEMBL10726179 | 0.74 | ALDH1A1 (0.52) | ALDH1A1HPGDL3MBTL1LMNAPOLB | |
| SCHEMBL11114226 | 0.74 | POLB (0.55) | ALDH1A1HPGDLMNAPOLBTSHR |
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 |