Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 5/20 | 0.37 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.37 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.37 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.37 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.37 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.37 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL24257818 | 1.00 | TDP1 (0.39) | TDP1MAPTGRIN2DGRIN3BGRIN1 | |
| SCHEMBL8884170 | 0.81 | GRIN2D (0.41) | TDP1MAPTGRIN2DGRIN3BGRIN1 | |
| SCHEMBL30600835 | 0.81 | GRIN2D (0.41) | TDP1MAPTGRIN2DGRIN3BGRIN1 | |
| SCHEMBL23647925 | 0.78 | GRIN2D (0.41) | TDP1MAPTGRIN2DGRIN3BGRIN1 | |
| SCHEMBL30546881 | 0.78 | GRIN2D (0.41) | TDP1MAPTGRIN2DGRIN3BGRIN1 | |
| SCHEMBL9493607 | 0.77 | ALDH1A1 (0.37) | TDP1MAPTGRIN2DGRIN3BGRIN1 | |
| SCHEMBL1366268 | 0.75 | GRIN2D (0.40) | TDP1MAPTGRIN2DGRIN3BGRIN1 | |
| SCHEMBL1366985 | 0.75 | GRIN2D (0.40) | TDP1MAPTGRIN2DGRIN3BGRIN1 | |
| SCHEMBL203442 | 0.75 | GRIN2D (0.40) | TDP1MAPTGRIN2DGRIN3BGRIN1 | |
| SCHEMBL203339 | 0.75 | LMNA (0.43) | TDP1MAPTGRIN2DGRIN3BGRIN1 |
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-4522614-A1 | 8- AND 6-SUBSTITUTED PYRIDOPYRIMIDINE DERIVATIVES AS KRAS INHIBITORS | Beta Pharma, Inc. (US) | 2025-03-19 | — | — | EP | disclosed |
| CN-119156387-A | 8-Substituted and 6-substituted pyridopyrimidine derivatives as KRAS inhibitors | 贝达医药公司 | 2024-12-17 | — | — | CN | disclosed |
| WO-2023219941-A1 | 8- AND 6-SUBSTITUTED PYRIDOPYRIMIDINE DERIVATIVES AS KRAS INHIBITORS | BETA PHARMA, INC. (US) | 2023-11-16 | — | — | WO | disclosed |