Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 3/20 | 0.44 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | PDE5A | O76074 | 1/20 | 0.38 |
| ▸ | CALCRL | Q16602 | 2/20 | 0.36 |
| ▸ | PSEN1 | P49768 | 3/20 | 0.36 |
| ▸ | PSEN2 | P49810 | 3/20 | 0.36 |
| ▸ | APH1B | Q8WW43 | 3/20 | 0.36 |
| ▸ | NCSTN | Q92542 | 3/20 | 0.36 |
| ▸ | APH1A | Q96BI3 | 3/20 | 0.36 |
| ▸ | PSENEN | Q9NZ42 | 3/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL20835881 | 0.86 | RIPK1 (0.42) | RIPK1ALDH1A1TDP1PDE5ACALCRL | |
| SCHEMBL28907234 | 0.86 | PKM (0.41) | RIPK1GPR119ALDH1A1PDE5AMAOB | |
| SCHEMBL28515805 | 0.83 | CALCRL (0.47) | RIPK1GPR119ALDH1A1TDP1PDE5A | |
| SCHEMBL28529935 | 0.80 | PKM (0.40) | RIPK1GPR119ALDH1A1PDE5APSEN1 | |
| SCHEMBL31479820 | 0.79 | RIPK1 (0.47) | RIPK1GPR119ALDH1A1PDE5APSEN1 | |
| SCHEMBL28526559 | 0.78 | ABCB1 (0.40) | RIPK1GPR119 | |
| SCHEMBL20835546 | 0.78 | RIPK1 (0.42) | RIPK1GPR119ALDH1A1TDP1PDE5A | |
| SCHEMBL28908006 | 0.75 | RIPK1 (0.49) | RIPK1GPR119ALDH1A1TDP1PDE5A | |
| SCHEMBL20835738 | 0.74 | PKM (0.43) | RIPK1ALDH1A1BCHEMAOB | |
| SCHEMBL28515213 | 0.74 | PKM (0.41) | RIPK1GPR119ALDH1A1PDE5ACALCRL |
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 |