Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10326595 | 1.00 | CYP1A2 (0.44) | CYP1A2CYP2D6CYP2C19KDM4ENPC1 | |
| SCHEMBL10326467 | 1.00 | CYP1A2 (0.44) | CYP1A2CYP2D6CYP2C19KDM4ENPC1 | |
| SCHEMBL10326278 | 0.87 | HPGD (0.45) | CYP1A2CYP2D6CYP2C19KDM4ENPC1 | |
| SCHEMBL10326277 | 0.87 | HPGD (0.45) | CYP1A2CYP2D6CYP2C19KDM4ENPC1 | |
| SCHEMBL8354404 | 0.86 | CYP1A2 (0.44) | CYP1A2CYP2D6CYP2C19KDM4ENPC1 | |
| SCHEMBL10326564 | 0.84 | CYP1A2 (0.45) | CYP1A2CYP2D6CYP2C19KDM4ENPC1 | |
| SCHEMBL10326582 | 0.84 | CYP2D6 (0.62) | CYP1A2CYP2D6CYP2C19KDM4ENPC1 | |
| SCHEMBL10326879 | 0.84 | CYP1A2 (0.45) | CYP1A2CYP2D6CYP2C19KDM4ENPC1 | |
| SCHEMBL10326896 | 0.84 | CYP2D6 (0.62) | CYP1A2CYP2D6CYP2C19KDM4ENPC1 | |
| SCHEMBL10327263 | 0.84 | CYP2D6 (0.62) | CYP1A2CYP2D6CYP2C19KDM4ENPC1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2438989-B1 | USE OF ASYMMETRIC HYDROGENATION CATALYST | TAKASAGO PERFUMERY CO LTD (JP) | 2016-04-13 | — | — | EP | disclosed |
| EP-2543437-A2 | HOMOGENEOUS ASYMMETRIC HYDROGENATION CATALYST | Takasago International Corporation (JP) | 2013-01-09 | — | — | EP | disclosed |
| WO-2011108672-A2 | HOMOGENEOUS ASYMMETRIC HYDROGENATION CATALYST | 高砂香料工業株式会社 (JP) | 2011-09-09 | — | — | WO | disclosed |
| WO-2010140636-A1 | ASYMMETRIC HYDROGENATION CATALYST | 高砂香料工業株式会社 (JP) | 2010-12-09 | — | — | WO | disclosed |