Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 1/20 | 0.36 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 2/20 | 0.35 |
| ▸ | JAK1 | P23458 | 2/20 | 0.35 |
| ▸ | JAK3 | P52333 | 2/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | MME | P08473 | 1/20 | 0.33 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | LDHA | P00338 | 1/20 | 0.33 |
| ▸ | LDHB | P07195 | 1/20 | 0.33 |
| ▸ | ACACA | Q13085 | 3/20 | 0.33 |
| ▸ | ACACB | O00763 | 2/20 | 0.33 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29452821 | 1.00 | RIPK1 (0.36) | RIPK1SMYD3JAK2JAK1JAK3 | |
| SCHEMBL28721844 | 1.00 | RIPK1 (0.36) | RIPK1SMYD3JAK2JAK1JAK3 | |
| SCHEMBL29707757 | 0.94 | MME (0.36) | RIPK1SMYD3JAK2JAK1JAK3 | |
| SCHEMBL23041420 | 0.94 | MME (0.36) | RIPK1SMYD3JAK2JAK1JAK3 | |
| SCHEMBL29452729 | 0.94 | MME (0.36) | RIPK1SMYD3JAK2JAK1JAK3 | |
| SCHEMBL23051959 | 0.94 | MME (0.36) | RIPK1SMYD3JAK2JAK1JAK3 | |
| SCHEMBL23041425 | 0.94 | MME (0.36) | RIPK1SMYD3JAK2JAK1JAK3 | |
| SCHEMBL23041562 | 0.94 | MME (0.36) | RIPK1SMYD3JAK2JAK1JAK3 | |
| SCHEMBL29452313 | 0.92 | SMYD3 (0.36) | SMYD3JAK2JAK1JAK3IDO1 | |
| SCHEMBL23041513 | 0.91 | MME (0.36) | RIPK1SMYD3JAK2JAK1JAK3 |
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-114341132-A | Substituted 1, 3-phenylheteroaryl derivatives and their use in the treatment of diseases | 诺华股份有限公司 | 2022-04-12 | — | — | CN | disclosed |