Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | IDH1 | O75874 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 2/20 | 0.32 |
| ▸ | CTSK | P43235 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28458593 | 0.79 | TSHR (0.33) | MAPTTSHRGAA | |
| SCHEMBL28060472 | 0.79 | HTT (0.45) | KDM4ESMN1; SMN2POLBALDH1A1MAPT | |
| SCHEMBL28060559 | 0.77 | MAPT (0.40) | PIK3CDSMN1; SMN2IDH1MAPTTSHR | |
| SCHEMBL28060541 | 0.77 | NAMPT (0.35) | SMN1; SMN2MAPTTSHRGAA | |
| SCHEMBL28058825 | 0.76 | PIK3CD (0.33) | PIK3CDSMN1; SMN2MAPTTSHRGAA | |
| SCHEMBL28058833 | 0.76 | PIK3CD (0.33) | PIK3CDSMN1; SMN2MAPTTSHRGAA | |
| SCHEMBL28330619 | 0.72 | THRB (0.36) | ALDH1A1EPHX1CTSKEPHX2 | |
| SCHEMBL28278634 | 0.71 | TP53 (0.34) | KDM4EALDH1A1 | |
| SCHEMBL28265971 | 0.71 | ALDH1A1 (0.33) | SMN1; SMN2POLBALDH1A1MAPTCTSK | |
| SCHEMBL28060419 | 0.71 | MAPK1 (0.44) | KDM4EPOLBALDH1A1TSHRMAPK1 |
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-105399698-A | Aromatic heterocyclic derivatives and applications of aromatic heterocyclic derivatives in medicines | GUANGDONG HEC PHARMACEUTICAL | 2016-03-16 | — | — | CN | disclosed |