Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHKA | P35790 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | USP2 | O75604 | 2/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.39 |
| ▸ | CDC42BPB | Q9Y5S2 | 3/20 | 0.39 |
| ▸ | CDC42BPA | Q5VT25 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | ATR | Q13535 | 2/20 | 0.35 |
| ▸ | ATRIP | Q8WXE1 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HRH2 | P25021 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL31145125 | 0.98 | TSHR (0.42) | CHKATSHRUSP2ROCK2ROCK1 | |
| Hydrochloric Acid SCHEMBL30872395 | 0.96 | USP2 (0.41) | CHKATSHRUSP2ROCK2ROCK1 | |
| SCHEMBL30574633 | 0.83 | ATR (0.44) | PTGS2ATRATRIP | |
| SCHEMBL22324789 | 0.78 | LMNA (0.52) | POLBALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL30776859 | 0.74 | L3MBTL3 (0.39) | ATRATRIPHTR1AHTR3AHTR6 | |
| SCHEMBL30574606 | 0.74 | CASP6 (0.46) | TSHRALDH1A1KDM4EMAPTCASP1 | |
| SCHEMBL29767998 | 0.73 | ATR (0.43) | ATRATRIP | |
| SCHEMBL22324822 | 0.73 | MAP4K4 (0.36) | ATRATRIPKDM4E | |
| SCHEMBL22324979 | 0.73 | DHFR (0.43) | TSHRHPGDSMN1; SMN2 | |
| SCHEMBL22340529 | 0.72 | FASN (0.31) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023247670-A1 | NEW HETEROCYCLIC-CARBONYL-CYCLIC COMPOUNDS AS MAGL INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2023-12-28 | — | — | WO | disclosed |
| CN-110003214-A | Substituted pyrazolo [1,5-a] pyrimidine compound as TRK kinase inhibitor | 阵列生物制药公司 | 2019-07-12 | — | — | CN | disclosed |
| CN-106008523-B | Substituted pyrazolo [1,5-a] pyrimidine compound as TRK kinase inhibitor | 阵列生物制药公司 | 2019-01-25 | — | — | CN | disclosed |
| CN-108697708-A | Point mutation in TRK inhibitor resistant cancers and method related to this | 洛克索肿瘤学股份有限公司 | 2018-10-23 | — | — | CN | disclosed |
| CN-105263932-A | Heterocyclic compound | TAKEDA PHARMACEUTICAL | 2016-01-20 | — | — | CN | disclosed |