Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.58 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.58 |
| ▸ | MEN1 | O00255 | 2/20 | 0.58 |
| ▸ | MAPT | P10636 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | MGAM | O43451 | 1/20 | 0.57 |
| ▸ | NFKB1 | P19838 | 5/20 | 0.55 |
| ▸ | NFKB2 | Q00653 | 4/20 | 0.55 |
| ▸ | RELA | Q04206 | 4/20 | 0.55 |
| ▸ | SLC5A1 | P13866 | 7/20 | 0.51 |
| ▸ | SLC5A2 | P31639 | 7/20 | 0.51 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.51 |
| ▸ | TTR | P02766 | 1/20 | 0.51 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.51 |
| ▸ | DPP4 | P27487 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL10713091 | 1.00 | CYP3A4 (0.58) | CYP3A4CHRNA7MEN1MAPTKMT2A | |
| SCHEMBL14075645 | 0.88 | PDPK1 (0.69) | MEN1MAPTKMT2ANFKB1NFKB2 | |
| SCHEMBL4488317 | 0.81 | PTPN1 (0.65) | CYP3A4CHRNA7MEN1MAPTKMT2A | |
| SCHEMBL4488313 | 0.81 | PTPN1 (0.65) | CYP3A4CHRNA7MEN1MAPTKMT2A | |
| SCHEMBL17430408 | 0.80 | PDPK1 (0.59) | MAPTNFKB1NFKB2RELASLC5A1 | |
| Demethylxanthohumol SCHEMBL31051585 | 0.79 | MGAM (0.81) | CYP3A4CHRNA7MEN1MAPTKMT2A | |
| Demethylxanthohumol SCHEMBL1023989 | 0.79 | MGAM (0.81) | CYP3A4CHRNA7MEN1MAPTKMT2A | |
| Demethylxanthohumol SCHEMBL4834910 | 0.79 | MGAM (0.81) | CYP3A4CHRNA7MEN1MAPTKMT2A | |
| SCHEMBL2810332 | 0.77 | CYP3A4 (0.73) | CYP3A4CHRNA7MEN1MAPTKMT2A | |
| SCHEMBL2810335 | 0.77 | CYP3A4 (0.73) | CYP3A4CHRNA7MEN1MAPTKMT2A |
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-0292576-A1 | ANTI-ULCEROUS AGENT CONTAINING CHALCONE DERIVATIVE AS EFFECTIVE INGREDIENT AND NOVEL CHALCONE DERIVATIVES | TSUMURA & CO. (JP) | 1988-11-30 | — | — | EP | claimed |