Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDPS | P14324 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HTR3A | P46098 | 1/20 | 0.36 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | PRNP | P04156 | 1/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8154303 | 0.86 | FDPS (0.47) | FDPSKDM4EALDH1A1MAPTHPGD | |
| SCHEMBL8156861 | 0.78 | ALDH1A1 (0.41) | FDPSKDM4EALDH1A1MAPTHPGD | |
| SCHEMBL992781 | 0.76 | KDM4E (0.60) | KDM4EALDH1A1MEN1KMT2AHTR3A | |
| SCHEMBL31632586 | 0.76 | KDM4E (0.60) | KDM4EALDH1A1MEN1KMT2AHTR3A | |
| SCHEMBL12258284 | 0.74 | CASP1 (0.43) | KDM4EALDH1A1MAPTHPGDTDP1 | |
| SCHEMBL8152609 | 0.73 | CTNNB1 (0.34) | FDPSKDM4EALDH1A1MAPTHPGD | |
| SCHEMBL28614513 | 0.73 | KMT2A (0.39) | KDM4EALDH1A1MAPTTDP1MEN1 | |
| SCHEMBL18799865 | 0.72 | SLC2A1 (0.41) | KDM4EALDH1A1MAPTHPGDTDP1 | |
| SCHEMBL8142479 | 0.71 | KDM4E (0.36) | FDPSKDM4EALDH1A1MAPTHPGD | |
| SCHEMBL8152427 | 0.71 | PTGDR2 (0.43) | KDM4EALDH1A1MAPTMEN1KMT2A |
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-1019380-A2 | TRICYCLIC 3-OXO-PROPANENITRILE COMPOUNDS | PHARMACIA & UPJOHN S.p.A. (IT) | 2000-07-19 | — | — | EP | disclosed |
| WO-1999016753-A2 | TRICYCLIC 3-OXO-PROPANENITRILE COMPOUNDS | PHARMACIA & UPJOHN S.P.A. (IT) | 1999-04-08 | — | — | WO | disclosed |