Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 7/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.60 |
| ▸ | MEN1 | O00255 | 5/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.60 |
| ▸ | LMNA | P02545 | 3/20 | 0.60 |
| ▸ | ABCB11 | O95342 | 3/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.60 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.60 |
| ▸ | TSHR | P16473 | 2/20 | 0.60 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.60 |
| ▸ | THPO | P40225 | 2/20 | 0.60 |
| ▸ | MAPT | P10636 | 2/20 | 0.60 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.60 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.60 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.60 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL8914182 | 0.93 | ALOX15 (0.53) | CYP2C9CYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL7410229 | 0.91 | CYP2C9 (0.66) | CYP2C9CYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL8912942 | 0.90 | CYP2C9 (0.58) | CYP2C9CYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL8091433 | 0.89 | CYP2C9 (0.57) | CYP2C9CYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL8914719 | 0.89 | CYP2C9 (0.76) | CYP2C9CYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL11451831 | 0.88 | CYP2C9 (0.62) | CYP2C9CYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL11497442 | 0.88 | CYP2C9 (0.62) | CYP2C9CYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL7273889 | 0.85 | CYP2C9 (0.60) | CYP2C9CYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL29664498 | 0.85 | CYP2C9 (0.60) | CYP2C9CYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL30424965 | 0.84 | CYP2C9 (0.58) | CYP2C9CYP1A2CYP3A4CYP2C19MEN1 |
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 |