Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KA2 | Q15349 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | GLS | O94925 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL8283604 | 0.92 | LMNA (0.48) | RPS6KA2ALDH1A1LMNACA12CA9 | |
| SCHEMBL15968001 | 0.79 | CA12 (0.49) | ALDH1A1CA12CA9KDM4EMAPT | |
| SCHEMBL14928448 | 0.77 | CYP1A2 (0.46) | RPS6KA2ALDH1A1LMNACA12CA9 | |
| SCHEMBL13632832 | 0.76 | LMNA (0.48) | ALDH1A1LMNACA12CA9GLS | |
| SCHEMBL14923583 | 0.74 | MALT1 (0.42) | ALDH1A1CA12CA9ACHEKDM4E | |
| SCHEMBL30891235 | 0.74 | MALT1 (0.42) | ALDH1A1CA12CA9ACHEKDM4E | |
| SCHEMBL25336731 | 0.74 | LMNA (0.45) | RPS6KA2ALDH1A1LMNACA12CA9 | |
| SCHEMBL30554691 | 0.74 | LMNA (0.45) | RPS6KA2ALDH1A1LMNACA12CA9 | |
| SCHEMBL799702 | 0.74 | DRD3 (0.45) | RPS6KA2ALDH1A1LMNACA12CA9 | |
| SCHEMBL14909935 | 0.73 | ALDH1A1 (0.44) | ALDH1A1LMNACA12CA9GLS |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012002577-A1 | NOVEL NICOTINAMIDE DERIVATIVES OR SALTS THEREOF | 富士フイルム株式会社 (JP) | 2012-01-05 | — | — | WO | disclosed |