Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | CES2 | O00748 | 2/20 | 0.44 |
| ▸ | CES1 | P23141 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 5/20 | 0.42 |
| ▸ | CA2 | P00918 | 5/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL24426724 | 0.81 | FABP2 (0.30) | — | |
| SCHEMBL24426669 | 0.79 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2CES2CES1MAPT | |
| SCHEMBL24426620 | 0.77 | MAPT (0.49) | ALDH1A1SMN1; SMN2MAPTHPGDLMNA | |
| SCHEMBL2884253 | 0.71 | CES2 (0.58) | ALDH1A1SMN1; SMN2CES2CES1MAPT | |
| SCHEMBL2884255 | 0.71 | CES2 (0.58) | ALDH1A1SMN1; SMN2CES2CES1MAPT | |
| SCHEMBL24426646 | 0.70 | — | — | |
| SCHEMBL24426611 | 0.69 | KDM4E (0.47) | ALDH1A1SMN1; SMN2CES2CES1MAPT | |
| SCHEMBL2744704 | 0.69 | CES2 (0.56) | ALDH1A1SMN1; SMN2CES2CES1MAPT | |
| SCHEMBL2744701 | 0.69 | CES2 (0.56) | ALDH1A1SMN1; SMN2CES2CES1MAPT | |
| SCHEMBL28115320 | 0.69 | CES2 (0.56) | ALDH1A1SMN1; SMN2CES2CES1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-3741757-A1 | DIHYDROINDOLIZINONE DERIVATIVE | Daiichi Sankyo Company, Limited (JP) | 2020-11-25 | — | — | EP | disclosed |