Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KRAS | P01116 | 18/20 | 0.45 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.36 |
| ▸ | HTR3B | O95264 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | NCF1 | P14598 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | HTR1D | P28221 | 1/20 | 0.36 |
| ▸ | HTR1B | P28222 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | MTOR | P42345 | 1/20 | 0.36 |
| ▸ | HTR3A | P46098 | 1/20 | 0.36 |
| ▸ | HTR5A | P47898 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.36 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20975003 | 1.00 | KRAS (0.45) | KRASHTR3EHTR3BCYP1A2HTR1A | |
| SCHEMBL30188964 | 0.87 | KRAS (0.47) | KRASVHLCDK7CCNHMNAT1 | |
| SCHEMBL19947842 | 0.87 | KRAS (0.47) | KRASVHLCDK7CCNHMNAT1 | |
| SCHEMBL19948802 | 0.87 | KRAS (0.47) | KRASVHLCDK7CCNHMNAT1 | |
| SCHEMBL21777139 | 0.83 | KRAS (0.45) | KRASVHLCDK7CCNHMNAT1 | |
| SCHEMBL21777128 | 0.83 | KRAS (0.45) | KRASVHLCDK7CCNHMNAT1 | |
| SCHEMBL30547333 | 0.83 | KRAS (0.45) | KRASVHLCDK7CCNHMNAT1 | |
| SCHEMBL19948362 | 0.83 | KRAS (0.51) | KRASVHLCDK7CCNHMNAT1 | |
| SCHEMBL30188783 | 0.83 | KRAS (0.51) | KRASVHLCDK7CCNHMNAT1 | |
| SCHEMBL19948347 | 0.83 | KRAS (0.51) | KRASVHLCDK7CCNHMNAT1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3710439-B1 | KRAS G12C INHIBITORS | MIRATI THERAPEUTICS INC (US) | 2023-02-15 | — | — | EP | disclosed |