Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 6/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 5/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | HSPA5 | P11021 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | TSHR | P16473 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 4/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | TYR | P14679 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.42 |
| ▸ | BLM | P54132 | 3/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2163415 | 0.95 | CYP2C19 (0.53) | CYP2C19CYP2C9CYP1A2HIF1ASMN1; SMN2 | |
| SCHEMBL9647562 | 0.93 | CYP2C9 (0.52) | CYP2C19CYP2C9CYP1A2HIF1ASMN1; SMN2 | |
| SCHEMBL9647566 | 0.93 | CYP2C9 (0.52) | CYP2C19CYP2C9CYP1A2HIF1ASMN1; SMN2 | |
| SCHEMBL15625222 | 0.92 | CYP2C9 (0.50) | CYP2C19CYP2C9CYP1A2HIF1ASMN1; SMN2 | |
| SCHEMBL9765625 | 0.91 | ALDH1A1 (0.52) | CYP2C19CYP2C9CYP1A2HIF1ASMN1; SMN2 | |
| SCHEMBL17461403 | 0.90 | CYP2C9 (0.49) | CYP2C19CYP2C9CYP1A2HIF1ASMN1; SMN2 | |
| SCHEMBL20272914 | 0.89 | ALDH1A1 (0.50) | CYP2C19CYP2C9CYP1A2HIF1ASMN1; SMN2 | |
| SCHEMBL76570 | 0.89 | ALDH1A1 (0.54) | CYP2C19CYP2C9CYP1A2HIF1ASMN1; SMN2 | |
| SCHEMBL4558428 | 0.87 | ALDH1A1 (0.52) | CYP2C19CYP2C9CYP1A2HIF1ASMN1; SMN2 | |
| SCHEMBL29357192 | 0.87 | CYP2C9 (0.61) | CYP2C19CYP2C9CYP1A2HIF1ASMN1; SMN2 |
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-5075367-A | Low melting | ETHYL CORPORATION (US) | 1991-12-24 | — | — | US | claimed |