Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 6/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.38 |
| ▸ | CFTR | P13569 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 4/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3544272 | 0.74 | ALDH1A1 (0.37) | PTGS1MAPTGAAP2RX1HSD17B10 | |
| SCHEMBL3544271 | 0.74 | ALDH1A1 (0.37) | PTGS1MAPTGAAP2RX1HSD17B10 | |
| SCHEMBL4412147 | 0.73 | CES1 (0.48) | MAPTP2RX1HSD17B10ALDH1A1TSHR | |
| SCHEMBL9244918 | 0.71 | BCAT2 (0.40) | HSD17B10ALDH1A1TSHRHDAC3HDAC1 | |
| SCHEMBL9244924 | 0.71 | BCAT2 (0.40) | HSD17B10ALDH1A1TSHRHDAC3HDAC1 | |
| SCHEMBL3037744 | 0.71 | MAPT (0.50) | PTGS1MAPTGAAP2RX1HSD17B10 | |
| SCHEMBL30371054 | 0.71 | MAPT (0.50) | PTGS1MAPTGAAP2RX1HSD17B10 | |
| SCHEMBL14090840 | 0.69 | ALDH1A1 (0.43) | PTGS1MAPTGAAP2RX1HSD17B10 | |
| Anthranilic Acid SCHEMBL6294674 | 0.68 | MAPT (0.52) | PTGS1MAPTGAAP2RX1HSD17B10 | |
| SCHEMBL3728578 | 0.65 | MAPT (0.58) | MAPTGAAHSD17B10ALDH1A1CFTR |
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 |
|---|---|---|---|---|---|---|---|
| EP-3088397-B1 | COMPOUNDS THAT ABROGATE THE CELL CYCLE G2 CHECKPOINT FOR USE IN THE TREATMENT OF CANCER | CANBAS CO LTD (JP) | 2019-04-10 | — | — | EP | disclosed |