Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.31 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 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 | |
|---|---|---|---|---|
| SCHEMBL27089947 | 0.79 | PARP1 (0.45) | ALDH1A1ADRA2AADRA2BADRA2C | |
| SCHEMBL26027147 | 0.75 | ALDH1A1 (0.39) | ALDH1A1ADRA2AADRA2BADRA2C | |
| SCHEMBL29620364 | 0.75 | ALDH1A1 (0.39) | ALDH1A1ADRA2AADRA2BADRA2C | |
| SCHEMBL26026549 | 0.73 | RARG (0.46) | ALDH1A1 | |
| SCHEMBL29620356 | 0.73 | RARG (0.46) | ALDH1A1 | |
| SCHEMBL26026709 | 0.70 | RARG (0.46) | ALDH1A1 | |
| SCHEMBL29620357 | 0.70 | ALDH1A1 (0.41) | ALDH1A1ADRA2AADRA2BADRA2C | |
| SCHEMBL29620360 | 0.68 | THRA (0.42) | ALDH1A1 | |
| SCHEMBL24375474 | 0.68 | THRA (0.61) | — | |
| SCHEMBL29029719 | 0.68 | THRB (0.40) | ALDH1A1 |
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-2023154842-A1 | THR BETA ANALOGS AND USES THEREOF | MADRIGAL PHARMACEUTICALS, INC. (US) | 2023-08-17 | — | — | WO | disclosed |