Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | RAD52 | P43351 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | DGKA | P23743 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.37 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL2293053 | 0.98 | NAAA (0.45) | NAAANPSR1RAD52MEN1KMT2A | |
| Bromide SCHEMBL2761053 | 0.97 | NAAA (0.47) | NAAANPSR1RAD52MEN1KMT2A | |
| Bromide SCHEMBL2292017 | 0.97 | NAAA (0.47) | NAAANPSR1RAD52MEN1KMT2A | |
| Bromide SCHEMBL1412161 | 0.97 | NAAA (0.47) | NAAANPSR1RAD52MEN1KMT2A | |
| SCHEMBL2288344 | 0.95 | MEN1 (0.44) | NAAAMEN1KMT2AL3MBTL1MAPK1 | |
| Bromide SCHEMBL2296147 | 0.94 | MEN1 (0.43) | NAAAMEN1KMT2AL3MBTL1MAPK1 | |
| Bromide SCHEMBL2760616 | 0.88 | ALDH1A1 (0.43) | NAAANPSR1MEN1KMT2AL3MBTL1 | |
| Bromide SCHEMBL2291109 | 0.86 | MEN1 (0.37) | NAAAMEN1KMT2AL3MBTL1TSHR | |
| Hydrochloric Acid SCHEMBL1412107 | 0.85 | NAAA (0.47) | NAAANPSR1RAD52MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL1412122 | 0.85 | NAAA (0.47) | NAAANPSR1RAD52MEN1KMT2A |
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-2223915-A1 | Ionic liquid solvents | Dublin City University (IE) | 2010-09-01 | — | — | EP | disclosed |