Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 4/20 | 0.49 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | PRKDC | P78527 | 1/20 | 0.41 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL23555986 | 0.88 | ERN1 (0.54) | ERN1CYP2A6HDAC2PRKDCCHRM2 | |
| SCHEMBL5766614 | 0.84 | ERN1 (0.51) | ERN1CYP2A6HDAC2CYP1A2PRKDC | |
| SCHEMBL5848721 | 0.84 | CYP2A6 (0.52) | ERN1CYP2A6HDAC2CYP1A2PRKDC | |
| SCHEMBL31092063 | 0.84 | CYP2A6 (0.52) | ERN1CYP2A6HDAC2CYP1A2PRKDC | |
| SCHEMBL1772093 | 0.81 | ERN1 (0.49) | ERN1CYP2A6HDAC2PRKDCCHRM2 | |
| SCHEMBL5370456 | 0.81 | ERN1 (0.56) | ERN1CYP2A6HDAC2CYP1A2PRKDC | |
| SCHEMBL7384280 | 0.81 | MAOB (0.52) | ERN1CYP2A6HDAC2PRKDCPTGER2 | |
| SCHEMBL7504214 | 0.79 | ERN1 (0.55) | ERN1CYP2A6HDAC2CYP1A2PRKDC | |
| SCHEMBL24368388 | 0.79 | ERN1 (0.48) | ERN1CYP2A6HDAC2PRKDCCHRM2 | |
| SCHEMBL26325717 | 0.79 | ERN1 (0.48) | ERN1CYP2A6HDAC2PRKDCCHRM2 |
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-0526951-A1 | 3-Phenyl benzo b thiophenes as pesticidal compounds | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1993-02-10 | — | — | EP | disclosed |