Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 15/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | FYN | P06241 | 2/20 | 0.43 |
| ▸ | CYP51A1 | Q16850 | 2/20 | 0.43 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.43 |
| ▸ | PGR | P06401 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.43 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.43 |
| ▸ | DRD1 | P21728 | 1/20 | 0.43 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9833161 | 0.83 | CYP3A4 (0.50) | CYP3A4THRBCYP2C9LMNAFYN | |
| SCHEMBL9834680 | 0.80 | CYP3A4 (0.46) | CYP3A4THRBCYP2C9LMNAFYN | |
| SCHEMBL8815519 | 0.78 | CYP3A4 (0.61) | CYP3A4THRBCYP2C9LMNAFYN | |
| SCHEMBL8815515 | 0.78 | CYP3A4 (0.61) | CYP3A4THRBCYP2C9LMNAFYN | |
| SCHEMBL9834697 | 0.75 | CYP3A4 (0.43) | CYP3A4THRBCYP2C9LMNAFYN | |
| SCHEMBL9201672 | 0.75 | CYP3A4 (0.62) | CYP3A4THRBCYP2C9LMNAFYN | |
| SCHEMBL9201668 | 0.75 | CYP3A4 (0.62) | CYP3A4THRBCYP2C9LMNAFYN | |
| SCHEMBL9301874 | 0.73 | CYP3A4 (0.53) | CYP3A4THRBCYP2C9LMNAFYN | |
| SCHEMBL9306387 | 0.73 | CYP3A4 (0.53) | CYP3A4THRBCYP2C9LMNAFYN | |
| SCHEMBL9302602 | 0.73 | CYP3A4 (0.55) | CYP3A4THRBCYP2C9LMNAFYN |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0133248-B1 | 1,2,4-TRIAZOL-1-YL-DERIVATIVES | SHIONOGI & CO., LTD. (JP) | 1991-11-21 | — | — | EP | claimed |
| US-4612322-A | FUNGICIDES | SHIONOGI & CO., LTD. (JP) | 1986-09-16 | — | — | US | claimed |
| EP-0133248-A2 | 1,2,4-Triazol-1-yl-derivatives | SHIONOGI & CO., LTD. (JP) | 1985-02-20 | — | — | EP | claimed |