Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | ELANE | P08246 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | XDH | P47989 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL4394154 | 1.00 | MAPT (0.53) | MAPTHIF1AKMT2AELANEMEN1 | |
| SCHEMBL6955701 | 0.88 | MAPT (0.53) | MAPTHIF1AKMT2AELANEMEN1 | |
| SCHEMBL6818070 | 0.86 | CA12 (0.57) | MAPTKMT2AELANEMEN1ALDH1A1 | |
| SCHEMBL335266 | 0.86 | ALDH1A1 (0.61) | MAPTKMT2AMEN1ALDH1A1 | |
| SCHEMBL23705054 | 0.83 | CA1 (0.45) | MAPTKMT2AMEN1ALDH1A1ATM | |
| SCHEMBL17811353 | 0.83 | ALDH1A1 (0.51) | MAPTKMT2AMEN1ALDH1A1CYP2C9 | |
| SCHEMBL17067577 | 0.82 | MAPT (0.60) | MAPTHIF1AKMT2AMEN1ALDH1A1 | |
| SCHEMBL31401179 | 0.82 | CA12 (0.44) | MAPTKMT2AMEN1ALDH1A1CYP2C9 | |
| SCHEMBL2192295 | 0.82 | ALDH1A1 (0.50) | MAPTKMT2AMEN1ALDH1A1CYP2C9 | |
| SCHEMBL31395805 | 0.82 | CA1 (0.44) | MAPTKMT2AMEN1ALDH1A1CYP2C9 |
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-111253404-B | Nitrogen-containing heterocyclic compound and composition, preparation method and application thereof | 上海医药集团股份有限公司 | 2023-05-23 | — | — | CN | disclosed |