Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 7/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.41 |
| ▸ | USP2 | O75604 | 3/20 | 0.41 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | USP1 | O94782 | 14/20 | 0.39 |
| ▸ | WDR48 | Q8TAF3 | 14/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PIP4K2C | Q8TBX8 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL17829964 | 0.90 | CYP1A2 (0.37) | CYP1A2CYP3A4CYP2C19USP2CLK4 | |
| SCHEMBL17833283 | 0.90 | SYK (0.40) | CYP1A2CYP3A4CYP2C19CYP2D6TSHR | |
| SCHEMBL17829874 | 0.90 | RAD52 (0.47) | CYP1A2CYP3A4CYP2C19USP2CLK4 | |
| SCHEMBL17833161 | 0.88 | KMT2A (0.40) | ALDH1A1MEN1LMNAKMT2A | |
| SCHEMBL17833235 | 0.87 | SYK (0.43) | ALDH1A1KMT2AMAPK1 | |
| SCHEMBL17833279 | 0.87 | CTNNB1 (0.37) | ALDH1A1KMT2A | |
| SCHEMBL17833238 | 0.87 | TNKS (0.41) | ALDH1A1KMT2A | |
| SCHEMBL17833152 | 0.86 | ACP1 (0.42) | CYP1A2CYP3A4CYP2C19USP2CLK4 | |
| SCHEMBL17833280 | 0.85 | SYK (0.37) | USP1WDR48ALDH1A1MEN1KMT2A | |
| SCHEMBL17829910 | 0.85 | SYK (0.44) | CYP1A2CYP3A4CYP2C19CYP2D6TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016094730-A1 | HETEROCYCLIC COMPOUNDS AS ANTIBIOTIC POTENTIATORS | SYNERECA PHARMACEUTICALS, INC. (US) | 2016-06-16 | — | — | WO | disclosed |