Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | THRA | P10827 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.32 |
| ▸ | RELA | Q04206 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27833367 | 0.83 | NFKB1 (0.37) | KMT2AL3MBTL1THRATHRBHDAC6 | |
| SCHEMBL14894156 | 0.81 | HDAC6 (0.36) | L3MBTL1HDAC6HDAC1HDAC2 | |
| SCHEMBL23752124 | 0.81 | HDAC6 (0.46) | L3MBTL1HDAC6HDAC1HDAC2 | |
| SCHEMBL29239760 | 0.79 | HRH3 (0.34) | KMT2AL3MBTL1HDAC6NFKB1NFKB2 | |
| SCHEMBL1771789 | 0.77 | BTK (0.37) | KMT2AL3MBTL1HDAC6NFKB1NFKB2 | |
| SCHEMBL29239679 | 0.77 | L3MBTL1 (0.36) | KMT2AL3MBTL1HDAC6NFKB1NFKB2 | |
| SCHEMBL27813334 | 0.74 | HRH3 (0.36) | KMT2AHDAC6NFKB1NFKB2RELA | |
| SCHEMBL28534028 | 0.72 | ALDH1A1 (0.39) | KMT2AL3MBTL1HDAC6NFKB1NFKB2 | |
| SCHEMBL2622073 | 0.71 | HDAC6 (0.38) | KMT2AL3MBTL1THRBHDAC6HDAC1 | |
| SCHEMBL956549 | 0.71 | ALDH1A1 (0.42) | L3MBTL1HDAC6HDAC1HDAC2ALDH1A1 |
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-113166173-A | Spiro-sulfonamide derivatives as inhibitors of myeloid leukemia 1(MCL-1) protein | 普莱鲁德疗法有限公司 | 2021-07-23 | — | — | CN | disclosed |