Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 4/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | CA7 | P43166 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PDE4A | P27815 | 1/20 | 0.37 |
| ▸ | SNCA | P37840 | 1/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.37 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11080188 | 1.00 | HTT (0.40) | HTTCA1CA2CA7CA9 | |
| SCHEMBL11069313 | 0.88 | PTPN1 (0.49) | HTTCA1CA2CA7CA9 | |
| SCHEMBL11069316 | 0.88 | PTPN1 (0.49) | HTTCA1CA2CA7CA9 | |
| SCHEMBL11071406 | 0.87 | HTT (0.40) | HTTCA1CA2CA7CA9 | |
| SCHEMBL11071383 | 0.87 | HTT (0.40) | HTTCA1CA2CA7CA9 | |
| SCHEMBL11069174 | 0.85 | KDM1A (0.38) | HTTPTGS1PDE4ASNCAPDE3A | |
| SCHEMBL11069179 | 0.85 | KDM1A (0.38) | HTTPTGS1PDE4ASNCAPDE3A | |
| SCHEMBL11079291 | 0.84 | HTT (0.41) | HTTCA1CA2CA7CA9 | |
| SCHEMBL11079293 | 0.84 | HTT (0.41) | HTTCA1CA2CA7CA9 | |
| SCHEMBL11074774 | 0.84 | KDM1A (0.44) | HTTPTGS1PDE4ASNCAPDE3A |
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-0021775-B1 | SYNTHESIS OF 1RS,4SR,5RS-4-(4,8-DIMETHYL-5-HYDROXY-7-NONEN-1-YL)-4-METHYL-3,8-DIOXABICYCLO(3.2.1)OCTANE-1-ACETIC ACID AND INTERMEDIATES | ORTHO PHARMACEUTICAL CORPORATION (US) | 1984-09-26 | — | — | EP | disclosed |
| US-4237055-A | Synthesis of 1RS,4SR,5RS-4-(4,8-dimethyl-5-hydroxy-7-nonen-1-yl)-4-methyl-3,8-dioxabicyclo[3.2.1]octane-1-acetic acid | ORTHO PHARMACEUTICAL CORPORATION (US) | 1980-12-02 | — | — | US | disclosed |