Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | GABRA1 | P14867 | 5/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28187985 | 0.79 | ALDH1A1 (0.48) | ALDH1A1TDP1GABRA1GABRB2MEN1 | |
| SCHEMBL28191486 | 0.77 | ALDH1A1 (0.46) | ALDH1A1TDP1GABRA1GABRB2MEN1 | |
| SCHEMBL28883578 | 0.75 | ALDH1A1 (0.52) | ALDH1A1TDP1GABRA1GABRB2MEN1 | |
| SCHEMBL21298734 | 0.75 | ALDH1A1 (0.52) | ALDH1A1TDP1GABRA1GABRB2MEN1 | |
| SCHEMBL28883576 | 0.75 | ALDH1A1 (0.52) | ALDH1A1TDP1GABRA1GABRB2MEN1 | |
| SCHEMBL24283843 | 0.75 | ALDH1A1 (0.52) | ALDH1A1TDP1GABRA1GABRB2MEN1 | |
| SCHEMBL24283825 | 0.75 | ALDH1A1 (0.52) | ALDH1A1TDP1GABRA1GABRB2MEN1 | |
| SCHEMBL24283708 | 0.75 | ALDH1A1 (0.52) | ALDH1A1TDP1GABRA1GABRB2MEN1 | |
| SCHEMBL21298732 | 0.75 | ALDH1A1 (0.52) | ALDH1A1TDP1GABRA1GABRB2MEN1 | |
| SCHEMBL28716483 | 0.75 | ALDH1A1 (0.52) | ALDH1A1TDP1GABRA1GABRB2MEN1 |
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-2451779-B1 | ETOMIDATE ANALOGUES THAT DO NOT INHIBIT ADRENOCORTICAL STEROID SYNTHESIS | GEN HOSPITAL CORP (US) | 2014-09-03 | — | — | EP | disclosed |