Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 4/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | F2 | P00734 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL28823865 | 0.84 | RAPGEF4 (0.38) | RAPGEF4TSHRSMN1; SMN2HSD17B10CASP1 | |
| SCHEMBL20599543 | 0.83 | RAPGEF4 (0.35) | RAPGEF4TSHRSMN1; SMN2HSD17B10CASP1 | |
| SCHEMBL29624394 | 0.82 | TSHR (0.41) | RAPGEF4TSHRSMN1; SMN2HSD17B10CASP1 | |
| SCHEMBL21388018 | 0.82 | TSHR (0.41) | RAPGEF4TSHRSMN1; SMN2HSD17B10CASP1 | |
| SCHEMBL15018736 | 0.81 | RAPGEF4 (0.38) | RAPGEF4TSHRSMN1; SMN2HSD17B10CASP1 | |
| SCHEMBL31525012 | 0.79 | SMN1; SMN2 (0.32) | RAPGEF4TSHRSMN1; SMN2HSD17B10CASP1 | |
| SCHEMBL2656784 | 0.79 | RAPGEF4 (0.37) | RAPGEF4TSHRSMN1; SMN2HSD17B10CASP1 | |
| SCHEMBL4138945 | 0.77 | RAPGEF4 (0.42) | RAPGEF4TSHRSMN1; SMN2HSD17B10CASP1 | |
| SCHEMBL15965543 | 0.76 | L3MBTL1 (0.42) | RAPGEF4TSHRSMN1; SMN2HSD17B10CASP1 | |
| SCHEMBL10995940 | 0.76 | LMNA (0.44) | RAPGEF4TSHRSMN1; SMN2HSD17B10CASP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117800865-A | Synthesis method of N, N '-dimethyl-N, N' -dioctyl hexyl oxyethyl malonamide | 中核四0四有限公司 | 2024-04-02 | — | — | CN | disclosed |
| EP-3240783-A1 | NEW BENZIMIDAZOLE DERIVATIVES AS ANTIHISTAMINE AGENTS | FAES FARMA, S.A. (ES) | 2017-11-08 | — | — | EP | disclosed |
| WO-2016107848-A1 | NEW BENZIMIDAZOLE DERIVATIVES AS ANTIHISTAMINE AGENTS | FAES FARMA, S.A. (ES) | 2016-07-07 | — | — | WO | disclosed |