Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 5/20 | 0.59 |
| ▸ | GPR119 | Q8TDV5 | 4/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.45 |
| ▸ | MTOR | P42345 | 2/20 | 0.45 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.45 |
| ▸ | ATR | Q13535 | 2/20 | 0.45 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL31467845 | 0.81 | NR3C1 (0.56) | NR3C1GPR119MEN1KMT2AUSP2 | |
| SCHEMBL15325963 | 0.80 | GPR119 (0.55) | NR3C1GPR119KMT2ACYP3A4PIK3CA | |
| SCHEMBL3956002 | 0.80 | GPR119 (0.55) | NR3C1GPR119MEN1KMT2AUSP2 | |
| SCHEMBL30588176 | 0.78 | GPR119 (0.53) | NR3C1GPR119CYP3A4PIK3CAMTOR | |
| SCHEMBL26113241 | 0.78 | GPR119 (0.53) | NR3C1GPR119CYP3A4PIK3CAMTOR | |
| SCHEMBL26135227 | 0.78 | KMT2A (0.53) | NR3C1GPR119MEN1KMT2AUSP2 | |
| SCHEMBL31467864 | 0.78 | GPR119 (0.52) | NR3C1GPR119CYP3A4PIK3CAMTOR | |
| SCHEMBL31320725 | 0.78 | GPR119 (0.52) | NR3C1GPR119CYP3A4PIK3CAMTOR | |
| SCHEMBL514912 | 0.78 | GPR119 (0.52) | NR3C1GPR119CYP3A4PIK3CAMTOR | |
| SCHEMBL3614409 | 0.78 | KMT2A (0.40) | NR3C1MEN1KMT2AUSP2HPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021215545-A1 | ANTICANCER COMBINATION THERAPY WITH N-(1-ACRYLOYL-AZETIDIN-3-YL)-2-((1H-INDAZOL-3-YL)AMINO)METHYL)-1H-IMIDAZOLE-5-CARBOXAMIDE INHIBITOR OF KRAS-G12C | TAIHO PHARMACEUTICAL CO., LTD. (JP) | 2021-10-28 | — | — | WO | disclosed |