Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | BHMT | Q93088 | 1/20 | 0.32 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.31 |
| ▸ | KDM4A | O75164 | 1/20 | 0.31 |
| ▸ | PHF8 | Q9UPP1 | 1/20 | 0.31 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.31 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.30 |
| ▸ | GBA1 | P04062 | 1/20 | 0.30 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12074658 | 0.91 | ROCK2 (0.47) | TDP1ROCK2BHMTGBA1 | |
| SCHEMBL7964368 | 0.91 | TDP1 (0.50) | TDP1ROCK2LMNAGBA1 | |
| SCHEMBL11766819 | 0.88 | LMNA (0.48) | LMNABHMTKDM4CKDM4APHF8 | |
| SCHEMBL27985750 | 0.88 | LMNA (0.48) | LMNABHMTKDM4CKDM4APHF8 | |
| SCHEMBL852521 | 0.88 | LMNA (0.48) | LMNABHMTKDM4CKDM4APHF8 | |
| SCHEMBL28131594 | 0.88 | LMNA (0.48) | LMNABHMTKDM4CKDM4APHF8 | |
| SCHEMBL29182630 | 0.88 | LMNA (0.48) | LMNABHMTKDM4CKDM4APHF8 | |
| SCHEMBL23183597 | 0.83 | LMNA (0.43) | LMNABHMTGBA1 | |
| Phosphoric Acid SCHEMBL11078026 | 0.82 | FDPS (0.37) | LMNABHMTKDM4CKDM4APHF8 | |
| SCHEMBL105005 | 0.80 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0718282-B1 | Process for preparing alkyl esters of thioglycolic acid | MERCK PATENT GMBH (DE) | 2001-05-16 | — | — | EP | disclosed |
| EP-0718282-A1 | Process for preparing alkyl esters of thioglycolic acid | MERCK PATENT GmbH (DE) | 1996-06-26 | — | — | EP | disclosed |
| US-4615836-A | REACTING ALKYL, MERCAPTOALKANOL WITH CARBOXYLIC ACID; TITANIUM-CONTAINING CATALYST | PHILLIPS PETROLEUM COMPANY (US) | 1986-10-07 | — | — | US | disclosed |