Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | ACACB | O00763 | 2/20 | 0.41 |
| ▸ | ACACA | Q13085 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | LTA4H | P09960 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.37 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.36 |
| ▸ | HTR1D | P28221 | 1/20 | 0.36 |
| ▸ | HTR1B | P28222 | 1/20 | 0.36 |
| ▸ | RHEB | Q15382 | 1/20 | 0.35 |
| ▸ | BCL2 | P10415 | 1/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9703616 | 0.81 | PTGS1 (0.53) | PTGS1MEN1KMT2ACYP2D6ACACB | |
| SCHEMBL19317610 | 0.73 | PTGS1 (0.43) | PTGS1MEN1KMT2ACYP2D6NPC1 | |
| SCHEMBL582104 | 0.73 | ELANE (0.46) | LTA4HTSHRPAX8NR1H2BAX | |
| SCHEMBL765113 | 0.72 | PTGS1 (0.66) | PTGS1MEN1KMT2ACYP2D6ACACB | |
| SCHEMBL30358257 | 0.72 | PTGS1 (0.66) | PTGS1MEN1KMT2ACYP2D6ACACB | |
| Diphenylether SCHEMBL28334518 | 0.71 | LTA4H (0.60) | PTGS1MEN1KMT2ACYP2D6ACACB | |
| SCHEMBL13246116 | 0.71 | PTGS1 (0.44) | PTGS1MEN1KMT2ACYP2D6NPC1 | |
| Diphenylether SCHEMBL27923487 | 0.71 | LTA4H (0.67) | LTA4HTSHRPAX8NR1H2BAX | |
| SCHEMBL3117282 | 0.71 | ALDH1A1 (0.35) | MEN1KMT2A | |
| SCHEMBL14280731 | 0.70 | PTGS1 (0.73) | PTGS1MEN1KMT2ACYP2D6ACACB |
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-3904450-A1 | COMPOSITION AND MOLDED ARTICLE | Akita University (JP) | 2021-11-03 | — | — | EP | disclosed |