Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.68 |
| ▸ | RAB9A | P51151 | 2/20 | 0.68 |
| ▸ | TP53 | P04637 | 1/20 | 0.68 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.62 |
| ▸ | TSHR | P16473 | 4/20 | 0.62 |
| ▸ | LMNA | P02545 | 3/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.61 |
| ▸ | NPC1 | O15118 | 2/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.61 |
| ▸ | MAPT | P10636 | 4/20 | 0.60 |
| ▸ | HPGD | P15428 | 2/20 | 0.60 |
| ▸ | GAA | P10253 | 1/20 | 0.60 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.60 |
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL14716724 | 1.00 | KDM4E (0.68) | KDM4ERAB9ATP53HSD17B10ALDH1A1 | |
| SCHEMBL31156476 | 0.88 | TSHR (0.58) | KDM4ERAB9ATP53HSD17B10ALDH1A1 | |
| SCHEMBL31671076 | 0.88 | TSHR (0.58) | KDM4ERAB9ATP53HSD17B10ALDH1A1 | |
| SCHEMBL10073336 | 0.87 | KDM4E (0.81) | KDM4ERAB9ATP53HSD17B10ALDH1A1 | |
| SCHEMBL31156510 | 0.87 | TSHR (0.57) | KDM4ERAB9ATP53HSD17B10ALDH1A1 | |
| SCHEMBL31156517 | 0.87 | TSHR (0.57) | KDM4ERAB9ATP53HSD17B10ALDH1A1 | |
| SCHEMBL29635235 | 0.85 | TSHR (0.54) | KDM4ERAB9ATP53HSD17B10ALDH1A1 | |
| SCHEMBL14717045 | 0.85 | TSHR (0.54) | KDM4ERAB9ATP53HSD17B10ALDH1A1 | |
| SCHEMBL28227385 | 0.84 | TSHR (0.71) | KDM4ERAB9ATP53HSD17B10ALDH1A1 | |
| SCHEMBL12929591 | 0.79 | KDM4E (0.68) | KDM4ERAB9ATP53HSD17B10ALDH1A1 |
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-108707151-B | Pyrimido-pyridazinone compounds and uses thereof | 阿萨纳生物科技有限责任公司 | 2022-06-03 | — | — | CN | disclosed |