Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.40 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | TMEM97 | Q5BJF2 | 3/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.39 |
| ▸ | CALCRL | Q16602 | 2/20 | 0.39 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | BCL9 | O00512 | 1/20 | 0.38 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL20835724 | 0.91 | PKM (0.45) | PKMNPC1RAB9ASMN1; SMN2HTR2C | |
| SCHEMBL28528383 | 0.86 | PKM (0.39) | PKMNPC1RAB9ASMN1; SMN2HTR2C | |
| SCHEMBL28521949 | 0.86 | PKM (0.40) | PKMHTR2CALDH1A1LMNAHCRTR2 | |
| SCHEMBL20835868 | 0.85 | RIPK1 (0.46) | RIPK1CALCRL | |
| SCHEMBL28528682 | 0.84 | RIPK1 (0.47) | ALDH1A1RIPK1CALCRL | |
| SCHEMBL28521936 | 0.81 | CALCRL (0.49) | PKMHTR2CHCRTR2RIPK1TMEM97 | |
| SCHEMBL20835772 | 0.78 | RIPK1 (0.44) | LMNARIPK1CALCRL | |
| SCHEMBL28517243 | 0.78 | RIPK1 (0.44) | ALDH1A1LMNARIPK1CALCRL | |
| SCHEMBL20835797 | 0.76 | RIPK1 (0.48) | RIPK1CALCRLMEN1KMT2A | |
| SCHEMBL21093552 | 0.75 | PKM (0.41) | PKMALDH1A1LMNARIPK1TMEM97 |
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 |