Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 3/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.51 |
| ▸ | TSHR | P16473 | 5/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.51 |
| ▸ | HPGD | P15428 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | ABCB11 | O95342 | 3/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.51 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.51 |
| ▸ | GMNN | O75496 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | TP53 | P04637 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL9688992 | 0.94 | GAA (0.54) | NR1I2CYP2C9KDM4EHSD17B10CYP3A4 | |
| SCHEMBL7414856 | 0.88 | NR1I2 (0.67) | NR1I2CYP2C9KDM4EHSD17B10KMT2A | |
| SCHEMBL7025790 | 0.85 | NR1I2 (0.56) | NR1I2CYP2C9KDM4EHSD17B10KMT2A | |
| SCHEMBL3034560 | 0.83 | NR1I2 (0.73) | NR1I2CYP2C9KDM4EHSD17B10KMT2A | |
| SCHEMBL29676206 | 0.83 | NR1I2 (0.73) | NR1I2CYP2C9KDM4EHSD17B10KMT2A | |
| SCHEMBL7029360 | 0.82 | NR1I2 (0.61) | NR1I2CYP2C9KDM4EHSD17B10KMT2A | |
| SCHEMBL9806975 | 0.81 | MAPT (0.56) | NR1I2CYP2C9KDM4EHSD17B10KMT2A | |
| SCHEMBL7151696 | 0.79 | CYP2C9 (0.61) | NR1I2CYP2C9KDM4EHSD17B10KMT2A | |
| SCHEMBL10671259 | 0.79 | NR1I2 (0.45) | NR1I2CYP2C9KDM4EHSD17B10KMT2A | |
| SCHEMBL7281794 | 0.79 | NR1I2 (0.45) | NR1I2CYP2C9KDM4EHSD17B10KMT2A |
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-0126094-B1 | NEW 1,4-DIHYDROPYRIDINE ESTERS AND PREPARATION METHODS THEREOF AND DRUGS CONTAINING SAID ESTERS | CERMOL S.A. (CH) | 1990-06-20 | — | — | EP | disclosed |