Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C2 | P08235 | 3/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 7/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.45 |
| ▸ | MEN1 | O00255 | 5/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.45 |
| ▸ | THPO | P40225 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4447494 | 0.90 | CYP2C9 (0.55) | NR3C2CYP2C9CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL8509173 | 0.90 | CYP2C9 (0.55) | NR3C2CYP2C9CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL30192384 | 0.90 | CYP2C9 (0.55) | NR3C2CYP2C9CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL8912942 | 0.88 | CYP2C9 (0.58) | CYP2C9CYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL8091053 | 0.87 | NR3C2 (0.48) | NR3C2CYP2C9CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL8021648 | 0.83 | CYP2C9 (0.56) | CYP2C9CYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL6947811 | 0.82 | CYP1A2 (0.56) | NR3C2CYP2C9CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL6951166 | 0.81 | CYP2C9 (0.53) | CYP2C9CYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL9230837 | 0.80 | PYGM (0.51) | NR3C2 | |
| SCHEMBL6952048 | 0.79 | CYP2C9 (0.55) | NR3C2CYP2C9CYP1A2CYP3A4CYP2C19 |
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-5658934-A | Aryl-substituted alkoxycarbonyl-1,4-dihydropyridine-5-carboxylic acid esters | BAYER AKTIENGESELLSCHAFT (DE) | 1997-08-19 | — | — | US | disclosed |