Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.35 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21131230 | 0.81 | PDE4D (0.42) | KDM4EMAPTKMT2AADORA1ALDH1A1 | |
| SCHEMBL31737069 | 0.79 | MAPT (0.34) | KDM4EMAPTMEN1ALOX15KMT2A | |
| SCHEMBL25434756 | 0.79 | KDM5B (0.36) | KDM4EMAPTMEN1ALOX15KMT2A | |
| SCHEMBL31323678 | 0.79 | RAB9A (0.35) | KDM4EMAPTMEN1ALOX15KMT2A | |
| SCHEMBL16700326 | 0.78 | ADORA1 (0.39) | MAPTKMT2AADORA1ALDH1A1SMN1; SMN2 | |
| SCHEMBL29777591 | 0.78 | MAPK1 (0.40) | KDM4EMAPTMEN1KMT2AALDH1A1 | |
| SCHEMBL30752702 | 0.77 | OPRD1 (0.32) | CYP2D6 | |
| SCHEMBL9940798 | 0.74 | PARP1 (0.38) | KDM4EMAPTMEN1ALOX15KMT2A | |
| SCHEMBL20691676 | 0.74 | GABRG2 (0.42) | MAPTALDH1A1GABRG2GABRB3GABRA5 | |
| SCHEMBL15017805 | 0.74 | ALDH1A1 (0.43) | KDM4EMAPTMEN1KMT2AALDH1A1 |
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-116635380-A | PPARgamma modulators and methods of use | 卫材R&D管理有限公司 | 2023-08-22 | — | — | CN | disclosed |