Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.43 |
| ▸ | GLA | P06280 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | CASP7 | P55210 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 5/20 | 0.38 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.37 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4872138 | 0.86 | KDM4E (0.45) | KDM4EGLAMEN1CASP1CASP7 | |
| SCHEMBL27883062 | 0.80 | KDM4E (0.59) | KDM4EGLAMEN1CASP1CASP7 | |
| SCHEMBL30223689 | 0.79 | ALDH1A1 (0.39) | KDM4EGLAMEN1CASP1CASP7 | |
| SCHEMBL13538135 | 0.79 | ALDH1A1 (0.45) | KDM4EMEN1CASP1CASP7KMT2A | |
| SCHEMBL17194083 | 0.79 | CYP1A2 (0.53) | KDM4EGLAMEN1CASP1CASP7 | |
| SCHEMBL13957372 | 0.77 | CA1 (0.41) | KDM4EGLAMEN1CASP1CASP7 | |
| SCHEMBL25638913 | 0.76 | PDE5A (0.43) | KDM4EMEN1CASP1CASP7KMT2A | |
| SCHEMBL3237173 | 0.75 | KDM4E (0.40) | KDM4EGLAMEN1CASP1CASP7 | |
| SCHEMBL10063550 | 0.75 | MAOA (0.47) | HDAC1HDAC6 | |
| SCHEMBL3322075 | 0.74 | KDM4E (0.68) | KDM4EGLAHPGDHDAC6IDO1 |
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-3680233-A1 | NOVEL AMIDE COMPOUND, AND Pin1 INHIBITOR, THERAPEUTIC AGENT FOR INFLAMMATORY DISEASES AND THERAPEUTIC AGENT FOR CANCER THAT USE THE SAME | Hiroshima University (JP) | 2020-07-15 | — | — | EP | disclosed |