Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | SCD | O00767 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | GPR6 | P46095 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | DCK | P27707 | 1/20 | 0.39 |
| ▸ | CSNK2A1 | P68400 | 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 | |
|---|---|---|---|---|
| SCHEMBL20694348 | 0.90 | ALDH1A1 (0.50) | ALDH1A1HTTSMN1; SMN2MAPTTDP1 | |
| SCHEMBL20694324 | 0.85 | ALDH1A1 (0.49) | ALDH1A1HTTSMN1; SMN2MAPTTDP1 | |
| SCHEMBL20694196 | 0.85 | SCD (0.48) | ALDH1A1HTTSCD | |
| SCHEMBL20694198 | 0.85 | ALDH1A1 (0.49) | ALDH1A1HTTLMNASMN1; SMN2MAPT | |
| SCHEMBL20694255 | 0.84 | ALDH1A1 (0.48) | ALDH1A1HTTLMNASMN1; SMN2TSHR | |
| SCHEMBL20694381 | 0.82 | ALDH1A1 (0.45) | ALDH1A1HTTSMN1; SMN2MAPTTDP1 | |
| SCHEMBL5864969 | 0.82 | ALDH1A1 (0.43) | ALDH1A1HTTLMNASMN1; SMN2MAPT | |
| SCHEMBL20694177 | 0.81 | ALDH1A1 (0.52) | ALDH1A1HTTLMNASMN1; SMN2TSHR | |
| SCHEMBL20694252 | 0.80 | LMNA (0.49) | ALDH1A1HTTLMNASMN1; SMN2TSHR | |
| SCHEMBL20694344 | 0.80 | BPTF (0.44) | ALDH1A1HTTLMNASMN1; SMN2MAPT |
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-2019022223-A1 | CYCLIC AMINE DERIVATIVE AND USE THEREOF FOR MEDICAL PURPOSES | 東レ株式会社 | 2019-01-31 | — | — | WO | disclosed |