Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 4/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | BLM | P54132 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | GMNN | O75496 | 1/20 | 0.35 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9511287 | 0.87 | ALDH1A1 (0.41) | HIF1ASMN1; SMN2CYP2C9CYP2C19TP53 | |
| SCHEMBL49284 | 0.82 | ALDH1A1 (0.54) | HIF1ASMN1; SMN2CYP2C9CYP2C19TP53 | |
| SCHEMBL9514191 | 0.81 | SHBG (0.46) | HIF1ASMN1; SMN2CYP2C9CYP2C19TP53 | |
| SCHEMBL4558428 | 0.80 | ALDH1A1 (0.52) | HIF1ASMN1; SMN2CYP2C9CYP2C19TP53 | |
| Calcium SCHEMBL30526370 | 0.80 | ALDH1A1 (0.52) | HIF1ASMN1; SMN2CYP2C9CYP2C19TP53 | |
| SCHEMBL11983836 | 0.79 | ALDH1A1 (0.50) | HIF1ASMN1; SMN2CYP2C9CYP2C19TP53 | |
| SCHEMBL6265265 | 0.79 | ALDH1A1 (0.50) | HIF1ASMN1; SMN2CYP2C9CYP2C19TP53 | |
| SCHEMBL20272914 | 0.79 | ALDH1A1 (0.50) | HIF1ASMN1; SMN2CYP2C9CYP2C19TP53 | |
| SCHEMBL76570 | 0.78 | ALDH1A1 (0.54) | HIF1ASMN1; SMN2CYP2C9CYP2C19TP53 | |
| SCHEMBL1785393 | 0.78 | ALDH1A1 (0.43) | HIF1ASMN1; SMN2CYP2C9CYP2C19TP53 |
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 |
|---|---|---|---|---|---|---|---|
| US-4594077-A | Mixture of an organic nitrate ignition accelerator and a 1,3,5-trimethyl-2,4,6-tris(3,5-dialkyl-4-hydroxy benzyl)benzene | ETHYL CORPORATION (US) | 1986-06-10 | — | — | US | disclosed |