Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 8/20 | 0.52 |
| ▸ | PTGS2 | P35354 | 8/20 | 0.52 |
| ▸ | CYP27A1 | Q02318 | 1/20 | 0.46 |
| ▸ | CYP24A1 | Q07973 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 4/20 | 0.44 |
| ▸ | CA2 | P00918 | 4/20 | 0.44 |
| ▸ | CA4 | P22748 | 4/20 | 0.44 |
| ▸ | CA6 | P23280 | 4/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL30825588 | 1.00 | PTGS1 (0.52) | PTGS1PTGS2CYP27A1CYP24A1CA1 | |
| SCHEMBL29169537 | 1.00 | PTGS1 (0.52) | PTGS1PTGS2CYP27A1CYP24A1CA1 | |
| SCHEMBL2488144 | 0.95 | PTGS1 (0.51) | PTGS1PTGS2CYP27A1CYP24A1CA1 | |
| SCHEMBL9296275 | 0.94 | PTGS1 (0.50) | PTGS1PTGS2CYP27A1CYP24A1CA1 | |
| SCHEMBL29169556 | 0.80 | CYP26A1 (0.47) | PTGS1PTGS2CYP24A1CA1CA2 | |
| SCHEMBL16801959 | 0.80 | CYP26A1 (0.47) | PTGS1PTGS2CYP24A1CA1CA2 | |
| SCHEMBL29718876 | 0.80 | PTGS1 (0.42) | PTGS1PTGS2CA1CA2CA4 | |
| SCHEMBL29169529 | 0.80 | CYP26A1 (0.47) | PTGS1PTGS2CYP24A1CA1CA2 | |
| SCHEMBL9296383 | 0.76 | CYP27A1 (0.43) | PTGS1PTGS2CYP27A1CYP24A1CA1 | |
| SCHEMBL9295955 | 0.76 | CYP27A1 (0.43) | PTGS1PTGS2CYP27A1CYP24A1HTT |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117701516-A | Alkene reductase, enzyme preparation, nucleic acid, expression vector, preparation method and application | 河北工业大学 | 2024-03-15 | — | — | CN | disclosed |
| US-5276053-A | Dibenzothiopyranylamines | WARNER-LAMBERT COMPANY (US) | 1994-01-04 | — | — | US | disclosed |
| US-5180736-A | Treatment and prevention of brain disorders | WARNER-LAMBERT COMPANY (US) | 1993-01-19 | — | — | US | disclosed |
| US-5071853-A | Amine-substituted hexahydroindeno(2,1-b)pyrroles, -indeno(2,1-c)pyridines or -indeno(2,1-d)azepines; cerebral ischemia or infarction | WARNER-LAMBERT COMPANY | 1991-12-10 | — | — | US | disclosed |
| EP-0388977-A2 | Polycyclic amines useful as cerebrovascular agents | WARNER-LAMBERT COMPANY (US) | 1990-09-26 | — | — | EP | disclosed |