Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 2/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA4 | P22748 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19400548 | 0.81 | EPHX1 (0.39) | EPHX1S1PR3TSHRALDH1A1CA1 | |
| Hydrochloric Acid SCHEMBL27528154 | 0.78 | EPHX1 (0.45) | EPHX1S1PR3CA1CA2CA4 | |
| SCHEMBL15731643 | 0.77 | EPHX1 (0.34) | EPHX1S1PR3ALDH1A1CA1CA2 | |
| SCHEMBL13191373 | 0.76 | TAS1R3 (0.37) | EPHX1S1PR3TSHRCA1CA2 | |
| SCHEMBL8977212 | 0.75 | EPHX1 (0.34) | EPHX1S1PR3TSHRALDH1A1CA1 | |
| SCHEMBL20095525 | 0.73 | HSD11B1 (0.36) | EPHX1S1PR3CA1CA2CA4 | |
| SCHEMBL10129264 | 0.73 | HSD11B1 (0.36) | EPHX1S1PR3CA1CA2CA4 | |
| SCHEMBL10239846 | 0.73 | HSD11B1 (0.36) | EPHX1S1PR3CA1CA2CA4 | |
| SCHEMBL8054344 | 0.73 | FAAH (0.45) | TSHRALDH1A1HPGD | |
| SCHEMBL8977206 | 0.72 | ADH1A (0.33) | EPHX1S1PR3CA1SMN1; 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-0708097-A1 | Herbicidally active tetrazolinones | NIHON BAYER AGROCHEM K.K. (JP) | 1996-04-24 | — | — | EP | disclosed |