Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.37 |
| ▸ | TAB1 | Q15750 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
| ▸ | CCNC | P24863 | 3/20 | 0.36 |
| ▸ | CDK8 | P49336 | 3/20 | 0.36 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 3/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.33 |
| ▸ | PLAU | P00749 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | TNKS | O95271 | 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 | |
|---|---|---|---|---|
| SCHEMBL31053001 | 0.88 | KDM4E (0.36) | KDM4EMAPK1MAP3K7TAB1CCNC | |
| SCHEMBL29671322 | 0.81 | HTT (0.37) | MAP3K7TAB1CCNCCDK8HTT | |
| SCHEMBL22848034 | 0.81 | HTT (0.37) | MAP3K7TAB1CCNCCDK8HTT | |
| SCHEMBL23693838 | 0.79 | HRH4 (0.36) | — | |
| SCHEMBL24833024 | 0.77 | CCR1 (0.41) | ALDH1A1 | |
| SCHEMBL23685266 | 0.75 | — | — | |
| SCHEMBL20621313 | 0.74 | NOS3 (0.31) | — | |
| SCHEMBL19779245 | 0.74 | NOS3 (0.31) | — | |
| SCHEMBL21173560 | 0.73 | ALDH1A1 (0.33) | KDM4EMAPK1ALDH1A1 | |
| SCHEMBL17603692 | 0.72 | KDM4E (0.42) | KDM4EMAPK1ALDH1A1SMN1; SMN2MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114008037-B | Heterocyclic compounds as KRAS G12C inhibitors | 广东新契生物医药科技有限公司 | 2024-06-21 | — | — | CN | disclosed |
| CN-114008037-A | Heterocyclic compounds as KRAS G12C inhibitors | 广东新契生物医药科技有限公司 | 2022-02-01 | — | — | CN | disclosed |