Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.51 |
| ▸ | TSHR | P16473 | 3/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.50 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.50 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | CA2 | P00918 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.40 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | MMP8 | P22894 | 1/20 | 0.36 |
| ▸ | MMP14 | P50281 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3929628 | 1.00 | CYP3A4 (0.51) | CYP3A4TSHRTDP1ATMPRSS1 | |
| SCHEMBL27574699 | 0.84 | CYP3A4 (0.55) | CYP3A4TSHRTDP1ATMPRSS1 | |
| SCHEMBL9486603 | 0.82 | CYP3A4 (0.54) | CYP3A4TSHRTDP1ATMPRSS1 | |
| SCHEMBL9487064 | 0.82 | CYP3A4 (0.54) | CYP3A4TSHRTDP1ATMPRSS1 | |
| SCHEMBL9487338 | 0.82 | CYP3A4 (0.54) | CYP3A4TSHRTDP1ATMPRSS1 | |
| SCHEMBL9485736 | 0.81 | PRSS1 (0.54) | CYP3A4TSHRTDP1ATMPRSS1 | |
| SCHEMBL9486744 | 0.81 | PRSS1 (0.54) | CYP3A4TSHRTDP1ATMPRSS1 | |
| SCHEMBL6388508 | 0.80 | NAAA (0.46) | TSHRALDH1A1CA2LMNAZDHHC7 | |
| SCHEMBL9161765 | 0.80 | MAPT (0.44) | TSHRATMALDH1A1CA2ZDHHC7 | |
| SCHEMBL7250719 | 0.80 | CA2 (0.36) | CYP3A4TSHRTDP1ATMRECQL |
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-2392400-B1 | Homogeneous asymmetric hydrogenation method | TAKASAGO PERFUMERY CO LTD (JP) | 2014-05-07 | — | — | EP | disclosed |
| EP-2392400-A2 | Homogeneous asymmetric hydrogenation catalyst | Takasago International Corporation (JP) | 2011-12-07 | — | — | EP | disclosed |