Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | CDC7 | O00311 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | TGM2 | P21980 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | DGAT2 | Q96PD7 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL9434756 | 0.86 | CYP3A4 (0.39) | CYP19A1CDC7CYP1A2CYP1A1CYP3A4 | |
| SCHEMBL9433871 | 0.85 | PDE4A (0.37) | CDC7MAPT | |
| SCHEMBL9434449 | 0.85 | RPS6KA3 (0.46) | DAPK3KDM4ECDC7IDO1 | |
| SCHEMBL9434027 | 0.84 | SLC22A12 (0.40) | EGFRALDH1A1DAPK3KDM4ELMNA | |
| SCHEMBL9434562 | 0.82 | SLC22A12 (0.47) | ALDH1A1CDC7CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9434742 | 0.82 | GPBAR1 (0.41) | CYP19A1CYP3A4DGAT2KMT2ACYP2C9 | |
| SCHEMBL9433930 | 0.81 | GPBAR1 (0.36) | ALDH1A1HPGDCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9433405 | 0.81 | PDE4A (0.43) | ALDH1A1CDC7MAPTTGM2CYP1A2 | |
| SCHEMBL17520239 | 0.78 | CCNC (0.48) | ALDH1A1HPGDDAPK3KDM4ELMNA | |
| SCHEMBL9433625 | 0.78 | KMT2A (0.35) | ALDH1A1HPGDKDM4ETGM2IDO1 |
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-5276150-A | Vasodilators, anticoagulants, calcium channel blockers | FUJIREBIO INC. (JP) | 1994-01-04 | — | — | US | disclosed |
| EP-0400660-A1 | 1,4-dihydropyridine derivatives | FUJIREBIO INC. (JP) | 1990-12-05 | — | — | EP | disclosed |