Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.47 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
| ▸ | RPS6KA3 | P51812 | 4/20 | 0.43 |
| ▸ | TGFBR1 | P36897 | 3/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | CASP7 | P55210 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.42 |
| ▸ | GYS1 | P13807 | 1/20 | 0.42 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL14519450 | 0.79 | RPS6KA3 (0.66) | KMT2APOLBPIK3CATRPA1RPS6KA3 | |
| SCHEMBL6132074 | 0.71 | PIK3CA (0.47) | KMT2APOLBPIK3CATRPA1RPS6KA3 | |
| SCHEMBL6132047 | 0.70 | KMT2A (0.57) | KMT2ATGFBR1HTR7MAPTKDM4E | |
| SCHEMBL4171344 | 0.70 | MAPT (0.60) | MAPTHSD17B10KDM4EALDH1A1GAA | |
| SCHEMBL19698857 | 0.70 | ALDH1A1 (0.58) | KMT2AMAPTHSD17B10KDM4EALDH1A1 | |
| SCHEMBL8212313 | 0.67 | MAPT (0.45) | KMT2AMAPTHSD17B10KDM4EALDH1A1 | |
| SCHEMBL9488910 | 0.67 | NR4A2 (0.49) | KMT2AMAPTHSD17B10KDM4EALDH1A1 | |
| SCHEMBL16837157 | 0.66 | ALDH1A1 (0.52) | KMT2AMAPTHSD17B10KDM4EALDH1A1 | |
| SCHEMBL12844173 | 0.66 | POLB (0.49) | KMT2APOLBPIK3CATRPA1HTR7 | |
| SCHEMBL5248907 | 0.65 | RPS6KA3 (0.81) | KMT2ARPS6KA3TGFBR1HSD17B10KDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1435957-A4 | INHIBITORS OF GSK-3 AND CRYSTAL STRUCTURES OF GSK-3BETA PROTEIN AND PROTEIN COMPLEXES | VERTEX PHARMA (US) | 2005-04-13 | — | — | EP | claimed |
| EP-1435957-A2 | INHIBITORS OF GSK-3 AND CRYSTAL STRUCTURES OF GSK-3BETA PROTEIN AND PROTEIN COMPLEXES | Vertex Pharmaceuticals Incorporated (US) | 2004-07-14 | — | — | EP | claimed |
| WO-2002088078-A2 | INHIBITORS OF GSK-3 AND CRYSTAL STRUCTURES OF GSK-3β PROTEIN AND PROTEIN COMPLEXES | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2002-11-07 | — | — | WO | claimed |