Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 1/20 | 0.44 |
| ▸ | MET | P08581 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | DPP4 | P27487 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8928269 | 0.86 | SMN1; SMN2 (0.46) | CHRNA7METCYP2A6ALDH1A1MAPT | |
| SCHEMBL8928246 | 0.79 | IDO1 (0.44) | METCYP2A6MAPTCYP1A2CYP3A4 | |
| SCHEMBL8928248 | 0.73 | CACNA1C (0.49) | ALDH1A1MAPTKMT2ACYP1A2CYP3A4 | |
| SCHEMBL13295965 | 0.71 | CUL4A (0.53) | METALDH1A1MAPTKMT2ACYP1A2 | |
| SCHEMBL27965992 | 0.70 | GRM5 (0.51) | CYP2A6ALDH1A1KDM4EADORA3SMN1; SMN2 | |
| SCHEMBL13295967 | 0.70 | ALDH1A1 (0.53) | ALDH1A1MAPTKMT2AKDM4EHPGD | |
| SCHEMBL11926858 | 0.69 | CYP2A6 (0.62) | CHRNA7CYP2A6ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL4442073 | 0.69 | KMO (0.41) | METALDH1A1MAPTKMT2ACYP1A2 | |
| SCHEMBL9454459 | 0.68 | CYP2A6 (0.53) | CHRNA7CYP2A6ALDH1A1KMT2ACYP1A2 | |
| SCHEMBL8928234 | 0.67 | GRK6 (0.43) | CHRNA7CYP2A6ALDH1A1CYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0755931-A1 | Dihydropyridine and pyridine derivatives and process for their preparation | PHARMACIA & UPJOHN S.p.A. (IT) | 1997-01-29 | — | — | EP | claimed |
| EP-0755931-A1 | Dihydropyridine and pyridine derivatives and process for their preparation | PHARMACIA & UPJOHN S.p.A. (IT) | 1997-01-29 | — | — | EP | disclosed |