Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | TTR | P02766 | 1/20 | 0.45 |
| ▸ | ALB | P02768 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.36 |
| ▸ | CDK1 | P06493 | 1/20 | 0.36 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.36 |
| ▸ | GSK3A | P49840 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.36 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.36 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.36 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.31 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.31 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL31459034 | 0.73 | CSNK2A1 (0.36) | — | |
| SCHEMBL17875688 | 0.73 | NQO2 (0.45) | MEN1KMT2AHTTCCNB2CDK1 | |
| Methane SCHEMBL27587790 | 0.72 | HPGDS (0.41) | MEN1TTRALBKMT2AHTT | |
| SCHEMBL30377453 | 0.69 | MAPT (0.42) | MEN1KMT2AHTTADRA2AADRA2B | |
| SCHEMBL16739214 | 0.69 | NR4A2 (0.39) | MEN1KMT2AHTTCCNB2CDK1 | |
| SCHEMBL24373627 | 0.69 | ESR2 (0.39) | MEN1KMT2AHTTCCNB2CDK1 | |
| SCHEMBL30789719 | 0.69 | NR4A2 (0.39) | MEN1KMT2AHTTCCNB2CDK1 | |
| SCHEMBL638491 | 0.69 | ALDH1A1 (0.35) | MEN1KMT2ACCNB2CDK1CCNB1 | |
| SCHEMBL25002420 | 0.69 | MAPT (0.42) | MEN1KMT2AHTTADRA2AADRA2B | |
| SCHEMBL30217734 | 0.69 | MAPK1 (0.33) | CCNB2CDK1CCNB1GSK3AGSK3B |
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-112638901-A | Novel pyrrolidinylamide compounds for the treatment of autoimmune diseases | 豪夫迈·罗氏有限公司 | 2021-04-09 | — | — | CN | disclosed |