Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 2/20 | 0.42 |
| ▸ | KLKB1 | P03952 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | REN | P00797 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28034366 | 0.89 | PPARG (0.40) | PPARGLMNARENHTTALDH1A1 | |
| SCHEMBL2218858 | 0.86 | ALDH1A1 (0.43) | PPARGLMNARENGAAMEN1 | |
| SCHEMBL2218506 | 0.86 | GAA (0.51) | PPARGLMNARENGAAMEN1 | |
| SCHEMBL2223484 | 0.86 | HSD11B1 (0.47) | PPARGLMNARENMEN1KMT2A | |
| SCHEMBL2219018 | 0.85 | HTT (0.52) | PPARGLMNARENKMT2AHTT | |
| SCHEMBL2220831 | 0.85 | REN (0.42) | PPARGLMNARENGAAMEN1 | |
| SCHEMBL2221127 | 0.82 | KMT2A (0.58) | LMNARENGAAMEN1KMT2A | |
| SCHEMBL2220649 | 0.80 | ALDH1A1 (0.42) | PPARGRENMEN1KMT2AHTT | |
| SCHEMBL2221448 | 0.79 | CA1 (0.44) | PPARGRENMEN1KMT2AHTT | |
| SCHEMBL28034370 | 0.79 | REN (0.37) | PPARGLMNARENHTTALDH1A1 |
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-103373985-B | Heterocyclic compounds and their use | TAKEDA PHARMACEUTICAL CO.,LTD. (JP) | 2015-10-28 | — | — | CN | disclosed |