Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | GAA | P10253 | 4/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | NPC1 | O15118 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 6/20 | 0.51 |
| ▸ | MEN1 | O00255 | 4/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | ALOX12 | P18054 | 3/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | F2 | P00734 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8693075 | 0.89 | NPC1 (0.47) | ALDH1A1SMN1; SMN2GAAL3MBTL1RAB9A | |
| SCHEMBL8693750 | 0.84 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2GAARAB9ANPC1 | |
| SCHEMBL8699774 | 0.84 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2GAARAB9ANPC1 | |
| SCHEMBL8694579 | 0.84 | KMT2A (0.39) | ALDH1A1SMN1; SMN2GAAL3MBTL1RAB9A | |
| SCHEMBL8698386 | 0.82 | ALDH1A1 (0.42) | ALDH1A1SMN1; SMN2GAARAB9ANPC1 | |
| SCHEMBL8696818 | 0.81 | HTT (0.41) | ALDH1A1RAB9ANPC1MEN1KMT2A | |
| SCHEMBL8694568 | 0.80 | TEAD2 (0.39) | ALDH1A1SMN1; SMN2GAAL3MBTL1MAPT | |
| SCHEMBL8693986 | 0.80 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2GAARAB9ANPC1 | |
| SCHEMBL8692506 | 0.80 | TEAD2 (0.39) | ALDH1A1SMN1; SMN2GAAL3MBTL1MAPT | |
| SCHEMBL8693117 | 0.79 | MAPT (0.50) | ALDH1A1GAARAB9ANPC1MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5849779-A | Pyrazole derivatives and their pharmaceutical use | JAPAN ENERGY CORPORATION (JP) | 1998-12-15 | — | — | US | disclosed |
| EP-0810217-A1 | Pyrazole derivatives and their pharmaceutical use as smooth muscle cell growth inhibitors | JAPAN ENERGY CORPORATION (JP) | 1997-12-03 | — | — | EP | disclosed |