Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 6/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.47 |
| ▸ | KIF11 | P52732 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | HTT | P42858 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.42 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.42 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9302312 | 0.83 | KIF11 (0.49) | CYP3A4CYP1A2CYP2C19CYP2C9LMNA | |
| SCHEMBL9537387 | 0.74 | TDP1 (0.38) | CYP3A4CYP1A2LMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL10220170 | 0.74 | KIF11 (0.62) | CYP3A4CYP1A2CYP2C19CYP2C9LMNA | |
| SCHEMBL22601568 | 0.72 | KIF11 (0.51) | CYP3A4CYP1A2CYP2C19CYP2C9LMNA | |
| SCHEMBL9537381 | 0.71 | ALOX5 (0.53) | CYP1A2CYP2A6KDM4ESMN1; SMN2MAPT | |
| SCHEMBL19977476 | 0.70 | ALDH1A1 (0.53) | CYP3A4CYP1A2CYP2C19CYP2C9LMNA | |
| SCHEMBL27877200 | 0.70 | CYP2A6 (0.62) | CYP3A4CYP1A2CYP2C19CYP2C9LMNA | |
| SCHEMBL5489470 | 0.70 | KIF11 (0.45) | CYP3A4CYP1A2CYP2C19CYP2C9LMNA | |
| SCHEMBL14983678 | 0.69 | CYP2A6 (0.55) | CYP3A4CYP1A2CYP2C19CYP2C9LMNA | |
| SCHEMBL8016565 | 0.69 | CYP2A6 (0.65) | CYP3A4CYP1A2CYP2C19LMNAPOLB |
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-0569491-A4 | 2-SUBSTITUTED-4,6-DI-TERTIARY-BUTYL-5-HYDROXY-1,3-PYRIMIDINES USEFUL AS ANTIINFLAMMATORY AGENTS | — | 1993-11-24 | — | — | EP | claimed |