Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | GRM4 | Q14833 | 2/20 | 0.43 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.43 |
| ▸ | SELE | P16581 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | STK39 | Q9UEW8 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | PARG | Q86W56 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27281098 | 0.87 | ALDH1A1 (0.59) | CYP1A2CYP3A4ALDH1A1MAPTHSD17B10 | |
| SCHEMBL9770759 | 0.81 | LMNA (0.52) | CYP1A2CYP3A4CYP2C19ALDH1A1MAPT | |
| SCHEMBL30466068 | 0.79 | BACE1 (0.39) | CYP1A2CYP3A4CYP2C19ALDH1A1GRM4 | |
| SCHEMBL31159376 | 0.79 | CYP1A2 (0.43) | CYP1A2CYP3A4CYP2C19ALDH1A1KMT2A | |
| SCHEMBL18921091 | 0.79 | TUBB4A (0.57) | CYP1A2CYP3A4CYP2C19ALDH1A1GRM4 | |
| SCHEMBL25421913 | 0.78 | KMT2A (0.39) | CYP1A2CYP3A4CYP2C19ALDH1A1MAPT | |
| SCHEMBL30466094 | 0.78 | BACE1 (0.43) | CYP1A2CYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL31388488 | 0.78 | KDR (0.48) | CYP1A2CYP3A4CYP2C19NPC1 | |
| SCHEMBL30466077 | 0.78 | CYP1A2 (0.38) | CYP1A2CYP3A4CYP2C19ALDH1A1GRM4 | |
| SCHEMBL31388507 | 0.77 | KDR (0.43) | CYP1A2CYP3A4CYP2C19ALDH1A1 |
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-5102884-A | Controlling leukemia | ISHIHARA SANGYO KAISHA LTD. (JP) | 1992-04-07 | — | — | US | claimed |