Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28291283 | 0.85 | ALDH1A1 (0.35) | ALDH1A1S1PR5S1PR1CYP2D6KMT2A | |
| SCHEMBL28049321 | 0.85 | ALDH1A1 (0.40) | ALDH1A1ATMCYP2D6KMT2ALMNA | |
| SCHEMBL28085974 | 0.80 | DPP4 (0.34) | ALDH1A1ATMS1PR5S1PR1CYP2D6 | |
| SCHEMBL28086157 | 0.80 | LMNA (0.51) | ALDH1A1ATMCYP2D6KMT2ALMNA | |
| SCHEMBL27995211 | 0.80 | ATM (0.41) | ALDH1A1ATMCYP2D6KMT2ALMNA | |
| SCHEMBL28049253 | 0.80 | LMNA (0.47) | ALDH1A1ATMCYP2D6KMT2ALMNA | |
| Hydrochloric Acid SCHEMBL28314858 | 0.78 | LMNA (0.54) | ALDH1A1ATMCYP2D6KMT2ALMNA | |
| SCHEMBL27999947 | 0.78 | GAA (0.53) | ALDH1A1CYP2D6KMT2ALMNAGAA | |
| SCHEMBL28299375 | 0.78 | KCNA3 (0.43) | ALDH1A1ATMCYP2D6LMNAGAA | |
| Hydrochloric Acid SCHEMBL4509686 | 0.78 | ALDH1A1 (0.50) | ALDH1A1ATMKMT2ACNR1CNR2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102918042-B | 8-methyl-1-phenyl-imidazo [1,5-a ] pyrazine compounds | MERCK SHARP & DOHME B.V. (NL) | 2016-03-09 | — | — | CN | disclosed |