Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | PDE4A | P27815 | 1/20 | 0.48 |
| ▸ | BLM | P54132 | 1/20 | 0.48 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.48 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.48 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.48 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.48 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | PLK1 | P53350 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL8904899 | 0.88 | GRK6 (0.35) | CYP1A2CYP3A4CYP2C9HPGDALOX15 | |
| SCHEMBL8905805 | 0.87 | LMNA (0.38) | CYP1A2CYP3A4CYP2C9HPGDALOX15 | |
| SCHEMBL8905900 | 0.86 | LMNA (0.37) | CYP1A2CYP3A4CYP2C9HPGDTSHR | |
| SCHEMBL8904194 | 0.86 | CCNA2 (0.38) | CYP1A2CYP3A4CYP2C9HPGDALOX15 | |
| SCHEMBL8906156 | 0.86 | ALDH1A1 (0.35) | CYP2C9HPGDMEN1KMT2A | |
| SCHEMBL8905938 | 0.86 | MEN1 (0.38) | CYP1A2CYP3A4CYP2C9HPGDALOX15 | |
| SCHEMBL9030270 | 0.85 | PDE3B (0.42) | CYP1A2CYP3A4HPGDPDE4APDE4B | |
| SCHEMBL8904850 | 0.85 | ALDH1A1 (0.40) | CYP1A2CYP3A4CYP2C9HPGDTSHR | |
| SCHEMBL8904827 | 0.84 | PDE3B (0.36) | CYP1A2HPGDPDE4APDE4BPDE4C | |
| SCHEMBL8904574 | 0.84 | NPC1 (0.42) | HPGDMEN1KMT2A |
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-5622948-A | ANALGESICS | SYNTEX (U.S.A.) INC. (US) | 1997-04-22 | — | — | US | disclosed |
| EP-0714895-A1 | Pyrrole derivatives | F. Hoffmann-La Roche AG (CH) | 1996-06-05 | — | — | EP | disclosed |