Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRB | P24530 | 1/20 | 0.40 |
| ▸ | NAAA | Q02083 | 3/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.37 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.36 |
| ▸ | RYR2 | Q92736 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20177810 | 0.91 | FPR1 (0.44) | EDNRBNAAAASAH1 | |
| SCHEMBL20177800 | 0.84 | EDNRB (0.38) | EDNRBNAAAPKMHTTSMN1; SMN2 | |
| SCHEMBL20177571 | 0.81 | EDNRB (0.38) | EDNRBNAAAPKMHTTSMN1; SMN2 | |
| SCHEMBL20177637 | 0.81 | FPR1 (0.44) | NAAAPKMHTTSMN1; SMN2KMT2A | |
| SCHEMBL20177949 | 0.81 | FPR1 (0.52) | NAAAPKMHTTSMN1; SMN2ASAH1 | |
| SCHEMBL20177489 | 0.78 | FPR2 (0.44) | EDNRBPKMHTTSMN1; SMN2MEN1 | |
| SCHEMBL20177658 | 0.76 | FPR2 (0.48) | NAAAPKMHTTSMN1; SMN2ASAH1 | |
| SCHEMBL20177501 | 0.74 | FPR2 (0.47) | NAAAPKMHTTSMN1; SMN2ASAH1 | |
| SCHEMBL20177604 | 0.74 | FPR2 (0.47) | NAAAPKMHTTSMN1; SMN2ASAH1 | |
| SCHEMBL20177669 | 0.73 | FPR1 (0.43) | NAAAPKMHTTSMN1; SMN2KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018092916-A1 | NITROGEN-CONTAINING POLYCYCLIC HETEROCYCLIC DERIVATIVE | 宇部興産株式会社 | 2018-05-24 | — | — | WO | disclosed |