Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA7 | P43166 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | TEAD3 | Q99594 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13308050 | 0.91 | CA1 (0.45) | CA1CA2CA7CA9TEAD3 | |
| SCHEMBL21522127 | 0.87 | CA1 (0.55) | CA1CA2CA7CA9CYP2C19 | |
| SCHEMBL1975300 | 0.83 | CA1 (0.46) | CA1CA2CA7CA9TEAD3 | |
| SCHEMBL1975297 | 0.83 | CA1 (0.46) | CA1CA2CA7CA9TEAD3 | |
| SCHEMBL3269931 | 0.81 | TSHR (0.52) | CA1CA2CA7CA9TEAD3 | |
| SCHEMBL29706815 | 0.80 | EPHX2 (0.44) | FAAH | |
| SCHEMBL19949378 | 0.80 | EPHX2 (0.44) | FAAH | |
| SCHEMBL19949379 | 0.80 | EPHX2 (0.44) | FAAH | |
| SCHEMBL20231370 | 0.79 | TSHR (0.50) | CA1CA2CA7CA9TEAD3 | |
| SCHEMBL5491987 | 0.79 | CSNK1E (0.47) | CA1CA2CA7CA9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-5530143-A | REDUCTION OF (3S)-3-HYDROXYOCTANEDIOIC DIESTER WITH COMPLEX HYDRIDE | BASF AKTIENGESELLSCHAFT (DE) | 1996-06-25 | — | — | US | disclosed |
| EP-0487986-B1 | Process for the preparation of esters of (6s)-6,8-dihydroxyoctanoic acid | BASF AG (DE) | 1995-06-21 | — | — | EP | disclosed |
| EP-0487986-A2 | Process for the preparation of esters of (6s)-6,8-dihydroxyoctanoic acid | BASF Aktiengesellschaft (DE) | 1992-06-03 | — | — | EP | disclosed |