Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.54 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.51 |
| ▸ | CACNA1C | Q13936 | 4/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | ABCB11 | O95342 | 3/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.51 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | HPGD | P15428 | 3/20 | 0.51 |
| ▸ | TSHR | P16473 | 3/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.51 |
| ▸ | CACNA1F | O60840 | 3/20 | 0.51 |
| ▸ | CACNA1D | Q01668 | 3/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL11826599 | 0.89 | ADORA3 (0.60) | KDM4EHSD17B10PDE1CCYP1A2CYP3A4 | |
| SCHEMBL9765807 | 0.88 | CYP1A2 (0.60) | KDM4EHSD17B10PDE1CCYP1A2CYP3A4 | |
| SCHEMBL9434406 | 0.84 | KDM4E (0.58) | KDM4EHSD17B10PDE1CCYP1A2CYP3A4 | |
| SCHEMBL11525325 | 0.81 | NR3C2 (0.50) | KDM4EHSD17B10PDE1CCYP1A2CYP3A4 | |
| SCHEMBL9580965 | 0.81 | CYP2C9 (0.48) | KDM4EHSD17B10PDE1CCYP1A2CYP3A4 | |
| SCHEMBL9401663 | 0.81 | KDM4E (0.58) | KDM4EHSD17B10PDE1CCYP1A2CYP3A4 | |
| SCHEMBL7160175 | 0.77 | KDM4E (0.90) | KDM4EHSD17B10PDE1CCYP1A2CYP3A4 | |
| SCHEMBL9580964 | 0.76 | CYP2C9 (0.51) | KDM4EHSD17B10PDE1CCYP1A2CYP3A4 | |
| SCHEMBL6951320 | 0.76 | ADORA3 (0.76) | KDM4EHSD17B10PDE1CCYP1A2CYP3A4 | |
| SCHEMBL7414856 | 0.75 | NR1I2 (0.67) | KDM4EHSD17B10PDE1CCYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5286869-A | Vasodilators and anticoagulants | FUJIREBIO KABUSHIKI KAISHA (JP) | 1994-02-15 | — | — | US | disclosed |
| EP-0403957-A2 | Optical active 1,4-dihydropyridine derivates | FUJIREBIO INC. (JP) | 1990-12-27 | — | — | EP | disclosed |