Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | FDPS | P14324 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | DPP4 | P27487 | 3/20 | 0.35 |
| ▸ | DPP8 | Q6V1X1 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6129180 | 0.86 | ALDH1A1 (0.46) | ALDH1A1GAAHPGDHSD17B10KMT2A | |
| SCHEMBL4089646 | 0.82 | ALDH1A1 (0.43) | ALDH1A1GAAHPGDKMT2ALMNA | |
| SCHEMBL3898658 | 0.82 | ALDH1A1 (0.43) | ALDH1A1GAAHPGDHSD17B10KMT2A | |
| SCHEMBL28201107 | 0.82 | ALDH1A1 (0.43) | ALDH1A1GAAHPGDKMT2ALMNA | |
| SCHEMBL2961890 | 0.81 | ALDH1A1 (0.42) | ALDH1A1GAAHPGDKDM4EKMT2A | |
| SCHEMBL2110264 | 0.78 | SIGMAR1 (0.42) | ALDH1A1GAAHPGDKMT2ALMNA | |
| SCHEMBL3358932 | 0.78 | ALDH1A1 (0.40) | ALDH1A1GAAHPGDKDM4EHSD17B10 | |
| SCHEMBL7297454 | 0.78 | ALDH1A1 (0.65) | ALDH1A1GAAHPGDKMT2ALMNA | |
| SCHEMBL16496970 | 0.78 | KDM4E (0.46) | ALDH1A1GAAHPGDKDM4EKMT2A | |
| SCHEMBL3353702 | 0.78 | ALDH1A1 (0.40) | ALDH1A1GAAHPGDKDM4EKMT2A |
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-101610813-A | Quinuclidinol derivatives as muscarinic receptor antagonist | ASTRAZENECA AB (SE) | 2009-12-23 | — | — | CN | disclosed |