Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 6/20 | 0.51 |
| ▸ | CRHBP | P24387 | 1/20 | 0.51 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL19978171 | 0.88 | ALDH1A1 (0.51) | ALDH1A1KMT2AMAPTCRHBPCRHR2 | |
| SCHEMBL22165764 | 0.86 | MAPT (0.49) | ALDH1A1KMT2AMAPTCRHBPCRHR2 | |
| SCHEMBL7828183 | 0.85 | ALDH1A1 (0.54) | ALDH1A1KMT2AMAPTCRHBPCRHR2 | |
| SCHEMBL28260499 | 0.82 | MAPT (0.47) | ALDH1A1KMT2AMAPTCRHBPCRHR2 | |
| SCHEMBL2672728 | 0.80 | MAPT (0.59) | ALDH1A1KMT2AMAPTCRHBPCRHR2 | |
| SCHEMBL23213835 | 0.78 | MAPT (0.43) | ALDH1A1MAPTCRHBPCRHR2L3MBTL1 | |
| SCHEMBL29796157 | 0.78 | MAPT (0.43) | ALDH1A1MAPTCRHBPCRHR2L3MBTL1 | |
| SCHEMBL1205553 | 0.78 | GLO1 (0.49) | ALDH1A1KMT2AMAPTCRHBPCRHR2 | |
| SCHEMBL16979687 | 0.77 | ALDH1A1 (0.49) | ALDH1A1KMT2AMAPTTDP1TSHR | |
| SCHEMBL17742882 | 0.77 | ALDH1A1 (0.54) | ALDH1A1KMT2AMAPTCRHBPCRHR2 |
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-108026026-A | Beta-amino acids and analog and its application as the β-substituted of chemotherapeutics | 夸德里加生物科学公司 | 2018-05-11 | — | — | CN | disclosed |