Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | MPI | P34949 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 13/20 | 0.39 |
| ▸ | PRKD1 | Q15139 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SRC | P12931 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 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 | |
|---|---|---|---|---|
| SCHEMBL31159121 | 0.89 | HTR2C (0.39) | MEN1MAPTKMT2APARP1HTR2C | |
| SCHEMBL11901340 | 0.84 | PARP1 (0.44) | KDM4EMEN1ALDH1A1TP53GAA | |
| SCHEMBL11901695 | 0.79 | PARP1 (0.43) | KDM4EMEN1ALDH1A1TP53GAA | |
| SCHEMBL5330428 | 0.79 | PARP1 (0.49) | KDM4EMAPTPARP1 | |
| SCHEMBL619582 | 0.75 | PARP10 (0.37) | HTR2C | |
| SCHEMBL31159167 | 0.72 | NOTUM (0.47) | KDM4EMEN1ALDH1A1TP53GAA | |
| SCHEMBL31393728 | 0.72 | PARP10 (0.42) | HTR2C | |
| SCHEMBL14232642 | 0.71 | ERN1 (0.35) | HTR2C | |
| SCHEMBL25374470 | 0.71 | GRIA1 (0.45) | KDM4EALDH1A1TP53GAAMAPT | |
| SCHEMBL2260714 | 0.71 | GRIA1 (0.41) | KDM4EALDH1A1TP53GAAMAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102702044-A | Carbocyclic and heterocyclic arylsulfones as gamma secretase inhibitors | SCHERING CORP | 2012-10-03 | — | — | CN | disclosed |