Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.40 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | KHK | P50053 | 7/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 3/20 | 0.36 |
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | HTR2B | P41595 | 2/20 | 0.36 |
| ▸ | RBP4 | P02753 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23593003 | 0.80 | KHK (0.52) | ALDH1A1HPGDMEN1KMT2AMAPT | |
| SCHEMBL23192487 | 0.70 | KHK (0.77) | KHKPDE10A | |
| SCHEMBL12580747 | 0.70 | HPGD (0.51) | ALDH1A1HPGDMEN1KMT2AMAPT | |
| SCHEMBL31165520 | 0.67 | ADRB1 (0.57) | ALDH1A1HPGDMEN1KMT2AMAPT | |
| SCHEMBL22462975 | 0.65 | KMT2A (0.49) | ALDH1A1MEN1KMT2AMAPTMAPK1 | |
| SCHEMBL17720579 | 0.63 | HSP90AA1 (0.52) | ALDH1A1HPGDMEN1KMT2AMAPT | |
| SCHEMBL30456470 | 0.62 | KHK (0.62) | HPGDMAPK1HSD17B10KHKPDE10A | |
| SCHEMBL23753744 | 0.61 | HPGD (0.71) | HPGDMAPTMAPK1HSD17B10KHK | |
| SCHEMBL27029850 | 0.61 | KDM4E (0.44) | ALDH1A1HPGDMEN1KMT2AMAPT | |
| SCHEMBL14927263 | 0.61 | HSP90AA1 (0.63) | ALDH1A1HPGDMEN1KMT2AMAPT |
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-2021161023-A1 | COMPOUNDS USEFUL IN INHIBITING KETOHEXOKINASE AND METHODS OF MAKING AND USING THE SAME | INORBIT THERAPEUTICS AB (SE) | 2021-08-19 | — | — | WO | disclosed |