Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.44 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.43 |
| ▸ | NAMPT | P43490 | 3/20 | 0.41 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.40 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.37 |
| ▸ | DRD1 | P21728 | 1/20 | 0.37 |
| ▸ | HRH2 | P25021 | 1/20 | 0.37 |
| ▸ | HTR1B | P28222 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | HTR1E | P28566 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | HRH1 | P35367 | 1/20 | 0.37 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | TMEM97 | Q5BJF2 | 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 | |
|---|---|---|---|---|
| SCHEMBL21800237 | 0.87 | TMEM97 (0.56) | HTR1AADRA2AADRA2BADRA2CDRD1 | |
| SCHEMBL23854712 | 0.87 | TMEM97 (0.56) | HTR1AADRA2AADRA2BADRA2CDRD1 | |
| SCHEMBL21360338 | 0.81 | GPR119 (0.52) | NR1H2NAMPTGPR119USP30 | |
| SCHEMBL8236259 | 0.81 | GPR119 (0.52) | NR1H2NAMPTGPR119USP30 | |
| SCHEMBL6719383 | 0.80 | GPR119 (0.43) | ESR2NR1H2GPR119ALDH1A1LMNA | |
| SCHEMBL6719421 | 0.80 | GPR119 (0.43) | ESR2NR1H2GPR119ALDH1A1LMNA | |
| SCHEMBL21360346 | 0.79 | GRM5 (0.42) | HDAC1NR1H2GPR119ALDH1A1LMNA | |
| SCHEMBL16825013 | 0.79 | NR1H2 (0.44) | NR1H2GPR119ALDH1A1LMNAMAPT | |
| SCHEMBL18186285 | 0.79 | NR1H2 (0.44) | NR1H2GPR119ALDH1A1LMNAMAPT | |
| SCHEMBL14921110 | 0.79 | CNR1 (0.51) | NR1H2GPR119ALDH1A1LMNAMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3807270-A1 | NOVEL HETEROARYL HETEROCYCLYL COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASE | F. Hoffmann-La Roche AG (CH) | 2021-04-21 | — | — | EP | disclosed |
| WO-2019238616-A1 | NOVEL HETEROARYL HETEROCYCLYL COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASE | F. HOFFMANN-LA ROCHE AG (CH) | 2019-12-19 | — | — | WO | disclosed |