Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | MAOB | P27338 | 8/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | HIF1AN | Q9NWT6 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | CASP7 | P55210 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL996166 | 1.00 | SMN1; SMN2 (0.46) | SMN1; SMN2MAOBALDH1A1GAALMNA | |
| Hydrochloric Acid SCHEMBL999098 | 0.99 | SMN1; SMN2 (0.46) | SMN1; SMN2MAOBALDH1A1GAALMNA | |
| Hydrochloric Acid SCHEMBL999096 | 0.99 | SMN1; SMN2 (0.46) | SMN1; SMN2MAOBALDH1A1GAALMNA | |
| SCHEMBL997479 | 0.85 | MAOB (0.56) | MAOBDRD2DRD3HIF1ANMAPT | |
| SCHEMBL997477 | 0.85 | MAOB (0.56) | MAOBDRD2DRD3HIF1ANMAPT | |
| SCHEMBL996635 | 0.83 | MAOB (0.46) | SMN1; SMN2MAOBALDH1A1KMT2AHIF1AN | |
| SCHEMBL997033 | 0.83 | KEAP1 (0.56) | MAOBKDM4ECYP3A4HPGDABCG2 | |
| SCHEMBL997035 | 0.83 | KEAP1 (0.56) | MAOBKDM4ECYP3A4HPGDABCG2 | |
| SCHEMBL996637 | 0.83 | MAOB (0.46) | SMN1; SMN2MAOBALDH1A1KMT2AHIF1AN | |
| SCHEMBL996162 | 0.82 | MAOB (0.56) | SMN1; SMN2MAOBGAAKMT2AHIF1AN |
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-2011009826-A2 | NOVEL CHALCONE DERIVATIVES WITH CYTOTOXIC ACTIVITY | ADAMED Sp.z o.o. (PL) | 2011-01-27 | — | — | WO | disclosed |