Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | MLYCD | O95822 | 2/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | CTSS | P25774 | 3/20 | 0.32 |
| ▸ | CTSL | P07711 | 2/20 | 0.32 |
| ▸ | CTSB | P07858 | 2/20 | 0.32 |
| ▸ | CTSD | P07339 | 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 | |
|---|---|---|---|---|
| SCHEMBL19643491 | 0.93 | MEN1 (0.39) | MEN1KMT2ATSHRALDH1A1SMN1; SMN2 | |
| SCHEMBL16336838 | 0.87 | MEN1 (0.39) | MEN1KMT2ATSHRALDH1A1SMN1; SMN2 | |
| SCHEMBL16710495 | 0.85 | TSHR (0.38) | TSHRALDH1A1MAPTCA12CA1 | |
| SCHEMBL23765759 | 0.83 | CA12 (0.39) | TSHRALDH1A1SMN1; SMN2CA12CA1 | |
| SCHEMBL18758783 | 0.83 | CA12 (0.43) | ALDH1A1SMN1; SMN2CA12CA1CA2 | |
| SCHEMBL22278113 | 0.82 | CA14 (0.39) | MEN1KMT2AALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL1280292 | 0.82 | SSTR4 (0.40) | ALDH1A1SMN1; SMN2CA12CA1CA2 | |
| SCHEMBL15312506 | 0.82 | SMN1; SMN2 (0.38) | TSHRALDH1A1SMN1; SMN2CA12CA1 | |
| SCHEMBL4517916 | 0.82 | TSHR (0.37) | TSHRALDH1A1MAPTCASP1MLYCD | |
| SCHEMBL8028479 | 0.82 | MLYCD (0.44) | MEN1KMT2ATSHRALDH1A1MAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104072498-A | Synthetic method for (R)-N-[5-(2-methoxy-2-phenylacetyl)-1,4,5,6-tetrahydropyrrolo[3,4-c]pyrazole-3-yl]-4-(4-methyl piperazine-1-yl)benzamide | UNIV SHENYANG PHARMACEUTICAL | 2014-10-01 | — | — | CN | claimed |
| CN-104072498-B | (R) synthetic method of N [5 (2 methoxyl group 2 phenyl acetyl) 1,4,5,6 nafoxidines also [3,4 c] pyrazoles 3 base] 4 (4 methyl piperazine 1 base) Benzoylamide | 沈阳药科大学 | 2016-12-28 | — | — | CN | disclosed |
| CN-104072498-A | Synthetic method for (R)-N-[5-(2-methoxy-2-phenylacetyl)-1,4,5,6-tetrahydropyrrolo[3,4-c]pyrazole-3-yl]-4-(4-methyl piperazine-1-yl)benzamide | UNIV SHENYANG PHARMACEUTICAL | 2014-10-01 | — | — | CN | disclosed |
| EP-1000931-A1 | Process for producing an N-alkoxycarbonyl-N-cyanoethyl amino acid alkyl ester | TOKUYAMA CORPORATION (JP) | 2000-05-17 | — | — | EP | disclosed |