Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 4/20 | 0.51 |
| ▸ | KIF11 | P52732 | 1/20 | 0.51 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.51 |
| ▸ | ITGAV | P06756 | 2/20 | 0.51 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.50 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.50 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.50 |
| ▸ | CNR1 | P21554 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.47 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.46 |
| ▸ | KDR | P35968 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28047630 | 0.89 | CFD (0.57) | MGLLKIF11ITGB3ITGAVCYP17A1 | |
| SCHEMBL4082541 | 0.83 | MGLL (0.72) | MGLLKIF11CNR1MAPTHDAC6 | |
| SCHEMBL30164935 | 0.83 | MGLL (0.72) | MGLLKIF11CNR1MAPTHDAC6 | |
| SCHEMBL5211495 | 0.82 | PDK1 (0.55) | ITGB3NPC1ALDH1A1LMNAMAPT | |
| SCHEMBL13749770 | 0.81 | KIF11 (0.69) | MGLLKIF11ITGB3ITGAVCNR1 | |
| SCHEMBL8064236 | 0.81 | FGFR3 (0.64) | MGLLKIF11CNR1ALDH1A1FGFR3 | |
| SCHEMBL4091879 | 0.81 | CNR1 (0.71) | MGLLKIF11CNR1NPC1 | |
| SCHEMBL27965258 | 0.81 | JAK3 (0.50) | MGLLCYP17A1CYP11B1CYP11B2CNR1 | |
| SCHEMBL28047621 | 0.78 | CFD (0.52) | MGLLKIF11ITGB3ITGAVCNR1 | |
| SCHEMBL23713151 | 0.77 | PEPD (0.59) | KIF11NPC1ALDH1A1LMNAMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105111151-B | Aminopyridine derivative as PPAR- gamma modulators | 成都理工大学 | 2018-09-28 | — | — | CN | disclosed |
| CN-105111151-A | Aminopyrimidine derivative used as PPAR-gamma regulator | UNIV CHENGDU TECHNOLOGY | 2015-12-02 | — | — | CN | disclosed |