Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 2/20 | 0.51 |
| ▸ | CALCRL | Q16602 | 13/20 | 0.47 |
| ▸ | PDE5A | O76074 | 1/20 | 0.45 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20835372 | 0.90 | RIPK1 (0.51) | RIPK1CALCRLPDE5AMAOAMAOB | |
| SCHEMBL20835753 | 0.87 | RIPK1 (0.43) | RIPK1CALCRL | |
| SCHEMBL20835879 | 0.86 | RIPK1 (0.48) | RIPK1CALCRLPDE5AJAK2NTRK1 | |
| SCHEMBL20835474 | 0.86 | CALCRL (0.50) | RIPK1CALCRLPDE5A | |
| SCHEMBL20835532 | 0.86 | RIPK1 (0.48) | RIPK1CALCRLPDE5AJAK2NTRK1 | |
| SCHEMBL20835925 | 0.86 | CALCRL (0.49) | RIPK1CALCRLPDE5A | |
| SCHEMBL20835539 | 0.86 | CALCRL (0.49) | RIPK1CALCRLPDE5AMAOAMAOB | |
| SCHEMBL20843354 | 0.85 | CALCRL (0.51) | RIPK1CALCRL | |
| SCHEMBL20835515 | 0.85 | CALCRL (0.51) | RIPK1CALCRL | |
| SCHEMBL19803582 | 0.85 | CALCRL (0.51) | RIPK1CALCRL |
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-109476639-B | Pyrrolidine derivatives | 橘生药品工业股份有限公司 | 2021-02-26 | — | — | CN | disclosed |