Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | HTR5A | P47898 | 3/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | METAP1 | P53582 | 1/20 | 0.32 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.31 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.31 |
| ▸ | PARP1 | P09874 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL18734225 | 0.81 | — | — | |
| SCHEMBL11530207 | 0.78 | ADRA2A (0.41) | ADRA2AHTR5AMETAP1ALDH1A1CYP3A4 | |
| SCHEMBL18322409 | 0.77 | PNMT (0.43) | HTR2AHTR2CHTR2BALDH1A1 | |
| SCHEMBL11988468 | 0.76 | HTR2A (0.40) | ADRA2AHTR5AHTR2AHTR2CHTR2B | |
| SCHEMBL30560114 | 0.76 | CHRNB2 (0.41) | ADRA2AHTR5AMETAP1PARP10PARP11 | |
| SCHEMBL5068876 | 0.76 | CHRNB2 (0.41) | ADRA2AHTR5AMETAP1PARP10PARP11 | |
| Hydrochloric Acid SCHEMBL18706568 | 0.76 | PNMT (0.42) | HTR2AHTR2CHTR2BALDH1A1 | |
| Hydrochloric Acid SCHEMBL3118573 | 0.74 | CHRNB2 (0.39) | ADRA2AHTR5AMETAP1PARP10PARP11 | |
| SCHEMBL14886110 | 0.71 | ADRA2A (0.38) | ADRA2AHTR5AHTR2AHTR2CHTR2B | |
| SCHEMBL22549228 | 0.71 | HTR5A (0.33) | ADRA2AHTR5AMETAP1PARP10PARP11 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018104766-A1 | 3-(2,3-DIHYDRO-1H-INDEN-5-YL)PROPANOIC ACID DERIVATIVES AND THEIR USE AS NRF2 REGULATORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2018-06-14 | — | — | WO | disclosed |