Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 8/20 | 0.34 |
| ▸ | TSHR | P16473 | 5/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | USP2 | O75604 | 4/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | GRM5 | P41594 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21285089 | 0.92 | HIF1A (0.32) | CYP2D6TSHRHIF1ACYP1A2CYP2C9 | |
| SCHEMBL21285100 | 0.91 | HIF1A (0.33) | CYP2D6TSHRHIF1ACYP1A2CYP2C9 | |
| SCHEMBL21285251 | 0.88 | CYP2D6 (0.31) | CYP2D6TSHRHIF1ACYP1A2CYP2C9 | |
| SCHEMBL21285249 | 0.88 | HIF1A (0.31) | CYP2D6TSHRHIF1ACYP1A2CYP2C9 | |
| SCHEMBL24426494 | 0.88 | ALDH1A1 (0.37) | MEN1KMT2AALDH1A1 | |
| SCHEMBL22345592 | 0.87 | GPR183 (0.41) | GRM5 | |
| SCHEMBL21285253 | 0.87 | HIF1A (0.30) | TSHRHIF1ACYP1A2CYP2C9MEN1 | |
| SCHEMBL21285106 | 0.87 | CYP2D6 (0.34) | CYP2D6TSHRHIF1ACYP1A2GRM5 | |
| SCHEMBL23344451 | 0.86 | MMP13 (0.33) | CYP2D6TSHRCYP1A2CYP2C9MEN1 | |
| SCHEMBL24426581 | 0.86 | ALDH1A1 (0.35) | MEN1KMT2AALDH1A1MAPK1CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3752490-B1 | HERBICIDAL 3-AZASPIRO[5.5]UNDECANE-8,10-DIONE COMPOUNDS | SYNGENTA PARTICIPATIONS AG (CH) | 2021-12-15 | — | — | EP | disclosed |