Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 4/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.33 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.33 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8849619 | 0.80 | CYP2D6 (0.38) | CYP2D6CYP1A2CYP2C19CYP2C9HIF1A | |
| SCHEMBL4589689 | 0.80 | CYP2D6 (0.54) | CYP2D6CYP1A2CYP2C19HIF1AMAPT | |
| SCHEMBL7904051 | 0.80 | CYP2D6 (0.36) | CYP2D6CYP1A2CYP2C19MAPTLMNA | |
| SCHEMBL8992901 | 0.77 | CYP2C19 (0.34) | CYP2D6CYP1A2CYP2C19CYP2C9HIF1A | |
| SCHEMBL11542336 | 0.74 | CYP2D6 (0.42) | CYP2D6CYP1A2CYP2C19CYP2C9HIF1A | |
| SCHEMBL2292995 | 0.74 | CYP2D6 (0.42) | CYP2D6CYP1A2CYP2C19CYP2C9HIF1A | |
| SCHEMBL9293355 | 0.74 | CTSA (0.31) | — | |
| SCHEMBL9435626 | 0.72 | LMNA (0.41) | CYP2D6MAPTSMN1; SMN2LMNAMAPK1 | |
| SCHEMBL9127939 | 0.72 | CYP2D6 (0.31) | CYP2D6 | |
| SCHEMBL2291848 | 0.72 | THRA (0.38) | CYP2D6CYP1A2CYP2C9MAPTSMN1; SMN2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0885869-A1 | THERAPEUTIC AGENT FOR DIABETES | Japan Tobacco Inc. (JP) | 1998-12-23 | — | — | EP | disclosed |