Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.55 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.51 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.51 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.48 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 6/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | HPGD | P15428 | 5/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.47 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.45 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.45 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.45 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL17772337 | 0.79 | KDR (0.53) | PARP1ADORA3ADORA1MAPTALDH1A1 | |
| SCHEMBL4711326 | 0.78 | MAPT (0.63) | PARP1MAPTALDH1A1MEN1KMT2A | |
| SCHEMBL8618698 | 0.77 | PDE10A (0.62) | ADORA3ADORA1ALDH1A1MEN1KMT2A | |
| SCHEMBL10992146 | 0.76 | PARP1 (0.67) | PARP1ADORA3MAPTALDH1A1HPGD | |
| SCHEMBL11376092 | 0.76 | CASP6 (0.49) | MAPTALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL1034504 | 0.76 | ALDH1A1 (0.62) | MAPTALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL1034502 | 0.76 | PIM1 (0.48) | PARP1ADORA3MAPTALDH1A1HPGD | |
| SCHEMBL1076309 | 0.76 | PLAU (0.56) | PARP1ADORA3ADORA1ADORA2AALDH1A1 | |
| SCHEMBL28004161 | 0.75 | CCR1 (0.50) | MAPTALDH1A1HPGDKDM4ESLC40A1 | |
| SCHEMBL29918706 | 0.73 | TDP1 (0.71) | MAPTALDH1A1HPGDMEN1KMT2A |
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-5627193-A | MEDICAL DIAGNOSIS, CARDIOVASCULAR DIAORDERS AND PROTECTION OF ORGANS FOR TRANSPLANTATION | MITSUI TOATSU CHEMICALS, INC. (JP) | 1997-05-06 | — | — | US | disclosed |