Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | NAAA | Q02083 | 5/20 | 0.38 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.38 |
| ▸ | SPHK2 | Q9NRA0 | 4/20 | 0.36 |
| ▸ | SPHK1 | Q9NYA1 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29101112 | 0.86 | SIGMAR1 (0.56) | SIGMAR1CYP1A2EPHX1NAAAASAH1 | |
| SCHEMBL14740174 | 0.86 | SIGMAR1 (0.56) | SIGMAR1CYP1A2EPHX1NAAAASAH1 | |
| SCHEMBL14740413 | 0.84 | SIGMAR1 (0.52) | SIGMAR1CYP1A2EPHX1NAAAASAH1 | |
| SCHEMBL11258625 | 0.83 | SIGMAR1 (0.45) | SIGMAR1CYP1A2EPHX1HRH3NAAA | |
| SCHEMBL29101110 | 0.79 | CYP1A2 (0.56) | SIGMAR1CYP1A2EPHX1HRH3NAAA | |
| SCHEMBL9267046 | 0.79 | CYP1A2 (0.56) | SIGMAR1CYP1A2EPHX1HRH3NAAA | |
| SCHEMBL5215905 | 0.78 | CYP1A2 (0.58) | SIGMAR1CYP1A2EPHX1NAAA | |
| SCHEMBL11022936 | 0.78 | CYP1A2 (0.46) | SIGMAR1CYP1A2EPHX1HRH3NAAA | |
| SCHEMBL6610934 | 0.78 | SIGMAR1 (0.48) | SIGMAR1CYP1A2EPHX1NAAAASAH1 | |
| SCHEMBL11653901 | 0.78 | SIGMAR1 (0.70) | SIGMAR1CYP1A2EPHX1 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4341906-A | ANALGESICS | PFIZER INC. (US) | 1982-07-27 | — | — | US | disclosed |
| US-4310669-A | TETRALONE | PFIZER INC. (US) | 1982-01-12 | — | — | US | disclosed |
| US-4310529-A | ANALGESICS | PFIZER INC. (US) | 1982-01-12 | — | — | US | disclosed |
| US-4310668-A | Intermediates to 1,9-dihydroxyoctahydrophenanthrenes | PFIZER INC. (US) | 1982-01-12 | — | — | US | disclosed |
| US-4270005-A | ANALGESICS | PFIZER INC. (US) | 1981-05-26 | — | — | US | disclosed |
| US-4268523-A | ANALGESICS | PFIZER INC. (US) | 1981-05-19 | — | — | US | disclosed |
| US-4268692-A | ANALGESICS | PFIZER INC. (US) | 1981-05-19 | — | — | US | disclosed |
| US-4237133-A | ANALGESICS | PFIZER INC. (US) | 1980-12-02 | — | — | US | disclosed |
| US-4188495-A | 1,9-Dihydroxyoctahydrophenanthrenes and intermediates therefor | PFIZER INC. (US) | 1980-02-12 | — | — | US | disclosed |