Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAT2A | P31153 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | GPR3 | P46089 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | NPEPPS | P55786 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | NQO2 | P16083 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | RORA | P35398 | 1/20 | 0.41 |
| ▸ | RORC | P51449 | 1/20 | 0.41 |
| ▸ | RORB | Q92753 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11883218 | 0.83 | ALDH1A1 (0.53) | ATMMAPK1ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL10411158 | 0.81 | POLB (0.44) | GPR3MAPK1POLBALDH1A1KDM4E | |
| SCHEMBL14374699 | 0.76 | TSHR (0.49) | MAT2AL3MBTL1ATMMAPK1POLB | |
| SCHEMBL14374243 | 0.76 | MAT2A (0.44) | MAT2AL3MBTL1ATMMAPK1POLB | |
| SCHEMBL14374711 | 0.76 | PTGER4 (0.42) | MAT2AL3MBTL1ATMMAPK1POLB | |
| SCHEMBL14374207 | 0.75 | MAT2A (0.43) | MAT2AL3MBTL1ATMMAPK1POLB | |
| SCHEMBL14374838 | 0.75 | MAT2A (0.43) | MAT2AL3MBTL1ATMMAPK1POLB | |
| SCHEMBL14374577 | 0.75 | TOP2A (0.56) | ALDH1A1PGRRORARORCRORB | |
| SCHEMBL14374579 | 0.75 | HRH1 (0.47) | MAT2AL3MBTL1ATMMAPK1POLB | |
| SCHEMBL10970843 | 0.75 | GPR3 (0.48) | GPR3ALDH1A1KDM4EHSD17B10HPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-7312211-B2 | Pryanone compounds useful as reversible inhibitors of cysteine proteases | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. | 2007-12-25 | — | — | US | disclosed |