Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 10/20 | 0.74 |
| ▸ | NR1H4 | Q96RI1 | 7/20 | 0.74 |
| ▸ | CDC25A | P30304 | 1/20 | 0.63 |
| ▸ | CDC25B | P30305 | 1/20 | 0.63 |
| ▸ | CYP8B1 | Q9UNU6 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.57 |
| ▸ | SLC10A2 | Q12908 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.57 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.57 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.57 |
| ▸ | SLC10A1 | Q14973 | 1/20 | 0.57 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL294537 | 1.00 | GPBAR1 (0.74) | GPBAR1NR1H4CDC25ACDC25BCYP8B1 | |
| SCHEMBL19064984 | 0.91 | GPBAR1 (0.78) | GPBAR1NR1H4CYP2C19MEN1KMT2A | |
| SCHEMBL17641310 | 0.90 | GPBAR1 (0.72) | GPBAR1NR1H4CYP2C19MEN1KMT2A | |
| SCHEMBL15984655 | 0.89 | GPBAR1 (0.77) | GPBAR1NR1H4CYP2C19MEN1KMT2A | |
| SCHEMBL13811560 | 0.89 | GPBAR1 (0.77) | GPBAR1NR1H4CYP2C19MEN1KMT2A | |
| SCHEMBL23710531 | 0.89 | NR1H4 (0.77) | GPBAR1NR1H4CYP2C19MEN1KMT2A | |
| SCHEMBL17303269 | 0.89 | GPBAR1 (0.77) | GPBAR1NR1H4CYP2C19MEN1KMT2A | |
| SCHEMBL25926254 | 0.89 | GPBAR1 (0.76) | GPBAR1NR1H4CYP2C19MEN1KMT2A | |
| SCHEMBL25926256 | 0.89 | GPBAR1 (0.76) | GPBAR1NR1H4CYP2C19MEN1KMT2A | |
| SCHEMBL30532089 | 0.89 | GPBAR1 (0.67) | GPBAR1NR1H4CYP2C19MEN1KMT2A |
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-4252719-A | REMOVAL OF A TERTIARY HYDROGEN FROM A 5-A-STEROID BY CHLORINATING THE STEROID BEING FIRST ESTERIFIED BY AN IODOARYL-CONTAINING ESTERIFICATION AGENT | RESEARCH CORPORATION (US) | 1981-02-24 | — | — | US | disclosed |