Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 5/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | MMP13 | P45452 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.45 |
| ▸ | PTPRF | P10586 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL29114956 | 0.91 | PTPN1 (0.53) | DYRK1AFFAR1MEN1KMT2AMAPT | |
| SCHEMBL29114912 | 0.84 | CYP1A2 (0.58) | DYRK1AKMT2ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL30683706 | 0.84 | LMNA (0.53) | DYRK1ACYP2C19MEN1KMT2AMMP13 | |
| SCHEMBL29114917 | 0.84 | LMNA (0.53) | DYRK1ACYP2C19MEN1KMT2AMMP13 | |
| SCHEMBL29114941 | 0.84 | POLB (0.50) | MEN1KMT2ASMN1; SMN2MAPTGAA | |
| SCHEMBL29115001 | 0.83 | CYP1A2 (0.53) | CYP2C19MEN1KMT2ASMN1; SMN2MMP13 | |
| SCHEMBL29114944 | 0.83 | ALDH1A1 (0.53) | CYP2C19KMT2AMMP13MAPTRAB9A | |
| SCHEMBL29114964 | 0.82 | MAPT (0.53) | DYRK1AMEN1KMT2ASMN1; SMN2MAPT | |
| SCHEMBL29114968 | 0.81 | SMN1; SMN2 (0.61) | MEN1KMT2ASMN1; SMN2MAPTNPC1 | |
| SCHEMBL15472020 | 0.80 | DYRK1A (0.59) | DYRK1AMEN1KMT2ASMN1; SMN2MAPT |
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-117143019-A | As beta 2 Pyrazole amide derivatives of allosteric antagonists of the adrenergic receptors | 常州大学 | 2023-12-01 | — | — | CN | disclosed |