Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR5A1 | Q13285 | 7/20 | 0.42 |
| ▸ | NR5A2 | O00482 | 7/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8679556 | 1.00 | NR5A1 (0.42) | NR5A1NR5A2ALDH1A1TDP1MEN1 | |
| SCHEMBL8684254 | 0.93 | NR5A1 (0.38) | NR5A1NR5A2ALDH1A1TDP1MEN1 | |
| SCHEMBL10685439 | 0.77 | CYP1A2 (0.41) | NR5A1NR5A2MEN1HTTKMT2A | |
| SCHEMBL10680931 | 0.76 | CYP1A2 (0.40) | NR5A1NR5A2MEN1HTTKMT2A | |
| SCHEMBL10681284 | 0.74 | CYP1A2 (0.41) | NR5A1NR5A2MEN1HTTKMT2A | |
| SCHEMBL10680396 | 0.73 | CYP1A2 (0.40) | NR5A1NR5A2MEN1HTTKMT2A | |
| SCHEMBL4530505 | 0.73 | NR5A1 (0.38) | NR5A1NR5A2ALDH1A1TDP1 | |
| SCHEMBL10682111 | 0.72 | CYP1A2 (0.46) | NR5A1NR5A2HTTMAPT | |
| SCHEMBL10346113 | 0.70 | — | — | |
| SCHEMBL19066526 | 0.69 | CYP3A4 (0.33) | TDP1MEN1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-10057095-A | — | — | None | — | — | JP | disclosed |
| JP-H1057095-A | RACEMIC RESOLUTION OF 3-ACYLOXY-BICYCLO(3.3.0)OCTANE-7-ONE-2-CARBOXYLIC ESTER WITH STEREOSPECIFIC ENZYME OR BY MICRO-ORGANIC ACYLATE HYDROLYSIS | SCHERING AG | 1998-03-03 | — | — | JP | disclosed |