Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 1/20 | 0.52 |
| ▸ | RXRB | P28702 | 1/20 | 0.52 |
| ▸ | RXRG | P48443 | 1/20 | 0.52 |
| ▸ | CES2 | O00748 | 2/20 | 0.47 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | PRKCA | P17252 | 1/20 | 0.39 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.39 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | MLYCD | O95822 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17897037 | 0.86 | MRGPRX4 (0.51) | RXRARXRBRXRGCES2NOTUM | |
| SCHEMBL13099993 | 0.86 | RXRA (0.52) | RXRARXRBRXRGCES2NOTUM | |
| SCHEMBL16958304 | 0.85 | NOTUM (0.41) | RXRARXRBRXRGCES2NOTUM | |
| SCHEMBL23965684 | 0.84 | NOTUM (0.40) | RXRARXRBRXRGCES2NOTUM | |
| SCHEMBL96116 | 0.82 | CES2 (0.67) | RXRARXRBRXRGCES2NOTUM | |
| SCHEMBL9928607 | 0.81 | RXRA (0.49) | RXRARXRBRXRGCES2MAOB | |
| SCHEMBL16959714 | 0.81 | NOTUM (0.38) | RXRARXRBRXRGCES2NOTUM | |
| SCHEMBL10498757 | 0.80 | RXRA (0.48) | RXRARXRBMEN1KMT2AALDH1A1 | |
| SCHEMBL19590653 | 0.79 | NOTUM (0.44) | CES2NOTUMALDH1A1POLBMLYCD | |
| SCHEMBL17703914 | 0.79 | RXRA (0.47) | RXRARXRBRXRGCES2MAOB |
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-3452460-B1 | HETEROARYL-1,2,4-TRIAZOLE AND HETEROARYL-TETRAZOLE COMPOUNDS FOR CONTROLLING ECTOPARASITES | ELANCO TIERGESUNDHEIT AG (CH) | 2020-02-12 | — | — | EP | disclosed |