Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | NT5E | P21589 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | SNCA | P37840 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CASP6 | P55212 | 2/20 | 0.35 |
| ▸ | APEX1 | P27695 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4747154 | 0.81 | ALDH1A1 (0.39) | ALDH1A1HSD17B10LMNAGAATDP1 | |
| SCHEMBL27854375 | 0.76 | ALDH1A1 (0.54) | CASP3ALDH1A1HSD17B10HDAC6LMNA | |
| SCHEMBL29593464 | 0.74 | HDAC6 (0.47) | ALDH1A1HSD17B10HDAC6LMNATSHR | |
| SCHEMBL21713276 | 0.74 | HDAC6 (0.47) | ALDH1A1HSD17B10HDAC6LMNATSHR | |
| SCHEMBL6227705 | 0.74 | DYRK1A (0.45) | ALDH1A1HDAC6LMNAMAPTKMT2A | |
| SCHEMBL5339617 | 0.74 | ALDH1A1 (0.51) | ALDH1A1HSD17B10HDAC6LMNAMAPT | |
| SCHEMBL11046259 | 0.74 | NPC1 (0.53) | ALDH1A1HSD17B10MAPTGAATSHR | |
| SCHEMBL8088622 | 0.73 | NPC1 (0.62) | ALDH1A1HSD17B10LMNAMAPTGAA | |
| SCHEMBL6242913 | 0.73 | CA12 (0.35) | CASP3ALDH1A1HSD17B10HDAC6LMNA | |
| SCHEMBL9190125 | 0.72 | POLB (0.48) | CASP3ALDH1A1LMNAMAPTGAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008124524-A2 | ARYL SULFONAMIDE COMPOUNDS AS MODULATORS OF THE CCK2 RECEPTOR | JANSSEN PHARMACEUTICA N.V. (BE) | 2008-10-16 | — | — | WO | claimed |