Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.54 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | ALOX5 | P09917 | 5/20 | 0.51 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.50 |
| ▸ | TTPA | P49638 | 1/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7986272 | 0.88 | PTGS1 (0.56) | PTGS1PTGS2CYP1A2CYP3A4TSHR | |
| SCHEMBL16273940 | 0.88 | ALOX5 (0.56) | PTGS1PTGS2CYP1A2CYP3A4TSHR | |
| SCHEMBL7330589 | 0.84 | MEN1 (0.58) | ALOX5MEN1KMT2ATTPA | |
| SCHEMBL6028036 | 0.84 | CYP3A4 (0.63) | PTGS1PTGS2CYP1A2CYP3A4TSHR | |
| SCHEMBL5674832 | 0.84 | CYP3A4 (0.63) | PTGS1PTGS2CYP1A2CYP3A4TSHR | |
| SCHEMBL5675007 | 0.84 | CYP3A4 (0.63) | PTGS1PTGS2CYP1A2CYP3A4TSHR | |
| SCHEMBL9096916 | 0.83 | CYP3A4 (0.56) | PTGS1PTGS2CYP1A2CYP3A4TSHR | |
| SCHEMBL9094963 | 0.83 | CYP3A4 (0.56) | PTGS1PTGS2CYP1A2CYP3A4TSHR | |
| Ethane SCHEMBL4283975 | 0.83 | CYP3A4 (0.62) | PTGS1PTGS2CYP1A2CYP3A4TSHR | |
| SCHEMBL9655733 | 0.83 | CYP3A4 (0.58) | PTGS1PTGS2CYP1A2CYP3A4TSHR |
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-0445735-A1 | Melanogenesis-inhibiting endermic preparation | Sansho Seiyaku Co., Ltd. (JP) | 1991-09-11 | — | — | EP | claimed |
| US-4003919-A | INTERMEDIATES FOR ALPHA-TOCOPHEROL | HOFFMANN-LA ROCHE INC. (US) | 1977-01-18 | — | — | US | disclosed |