Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 5/20 | 0.37 |
| ▸ | NPC1 | O15118 | 4/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1202054 | 0.81 | NOTUM (0.37) | ALDH1A1MAPK1RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL1973038 | 0.80 | MAPK14 (0.36) | ALDH1A1RAB9ANPC1MAPTHPGD | |
| SCHEMBL5539865 | 0.80 | NISCH (0.37) | ALDH1A1RAB9ANPC1SMN1; SMN2KDM4E | |
| SCHEMBL435455 | 0.80 | CYP1A2 (0.38) | ALDH1A1MAPK1RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL2397171 | 0.79 | MAPT (0.42) | ALDH1A1RAB9ANPC1SMN1; SMN2KDM4E | |
| SCHEMBL5544984 | 0.76 | KIF11 (0.47) | NPC1MAPTCCNB2CDK1CCNB1 | |
| SCHEMBL11240403 | 0.76 | MAPT (0.46) | ALDH1A1MAPK1RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL5290073 | 0.76 | CYP11B2 (0.43) | CCNB2CDK1CCNB1GSK3AGSK3B | |
| SCHEMBL5541420 | 0.76 | CYP17A1 (0.41) | ALDH1A1MAPK1RAB9ANPC1KDM4E | |
| SCHEMBL1967426 | 0.76 | CLK4 (0.56) | ALDH1A1RAB9ANPC1SMN1; SMN2KDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011072207-A1 | AZOCYCLIC INHIBITORS OF FATTY ACID AMIDE HYDROLASE | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2011-06-16 | — | — | WO | disclosed |
| EP-1909775-A2 | FORMULATION OF RADIOPROTECTIVE ALPHA, BETA UNSATURATED ARYL SULFONES | Onconova Therapeutics, Inc. (US) | 2008-04-16 | — | — | EP | disclosed |
| WO-2007016201-A2 | FORMULATION OF RADIOPROTECTIVE α, β UNSATURATED ARYL SULFONES | ONCONOVA THERAPEUTICS, INC. (US) | 2007-02-08 | — | — | WO | disclosed |