Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.53 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.50 |
| ▸ | CASP3 | P42574 | 1/20 | 0.48 |
| ▸ | CASP7 | P55210 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.48 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.48 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | THRA | P10827 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7337631 | 0.85 | TAAR1 (0.57) | TAAR1FFAR4CASP3CASP7MEN1 | |
| SCHEMBL456436 | 0.83 | FFAR4 (0.67) | TAAR1FFAR4MEN1KMT2AALDH1A1 | |
| SCHEMBL2027905 | 0.83 | ALDH1A1 (0.62) | TAAR1FFAR4CASP3CASP7MEN1 | |
| SCHEMBL29842802 | 0.83 | ALDH1A1 (0.62) | TAAR1FFAR4CASP3CASP7MEN1 | |
| SCHEMBL3053513 | 0.81 | TAAR1 (0.58) | TAAR1FFAR4CASP3CASP7MEN1 | |
| SCHEMBL5824610 | 0.81 | TAAR1 (0.53) | TAAR1FFAR4CASP3CASP7MEN1 | |
| SCHEMBL24458263 | 0.81 | CTBP2 (0.57) | TAAR1CASP3CASP7ALDH1A1MAOB | |
| SCHEMBL10694899 | 0.80 | IAPP (0.57) | TAAR1FFAR4CASP3CASP7MEN1 | |
| Hydrochloric Acid SCHEMBL23721866 | 0.80 | TAAR1 (0.56) | TAAR1FFAR4CASP3CASP7MEN1 | |
| SCHEMBL1107166 | 0.79 | SIRT2 (0.52) | TAAR1FFAR4CASP3CASP7MEN1 |
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-2024050825-A1 | COMPOUNDS AS MLKL INHIBITORS | NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) | 2024-03-14 | — | — | WO | disclosed |