Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CTSK | P43235 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 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 | |
|---|---|---|---|---|
| SCHEMBL28534168 | 1.00 | EPHX1 (0.34) | EPHX1RIPK1ALDH1A1POLBSMN1; SMN2 | |
| SCHEMBL28529367 | 0.82 | CA2 (0.36) | EPHX1RIPK1ALDH1A1POLBSMN1; SMN2 | |
| SCHEMBL28529368 | 0.82 | CA2 (0.36) | EPHX1RIPK1ALDH1A1POLBSMN1; SMN2 | |
| SCHEMBL8843145 | 0.76 | EPHX1 (0.35) | EPHX1ALDH1A1POLBSMN1; SMN2CA2 | |
| SCHEMBL24380351 | 0.75 | EPHX1 (0.41) | EPHX1ALDH1A1POLBSMN1; SMN2CA2 | |
| SCHEMBL18358245 | 0.73 | EPHX1 (0.36) | EPHX1ALDH1A1POLBSMN1; SMN2CA2 | |
| SCHEMBL26200749 | 0.72 | RIPK1 (0.32) | RIPK1 | |
| SCHEMBL25590071 | 0.71 | ASAH1 (0.36) | RIPK1POLB | |
| SCHEMBL25590075 | 0.71 | ASAH1 (0.36) | RIPK1POLB | |
| SCHEMBL25590074 | 0.71 | ASAH1 (0.36) | RIPK1POLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-112480121-A | Polycyclic derivative and preparation thereof | 四川海思科制药有限公司 | 2021-03-12 | — | — | CN | disclosed |