Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.40 |
| ▸ | CFTR | P13569 | 6/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 3/20 | 0.38 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.37 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL28491736 | 0.85 | POLB (0.44) | KDM4ECFTRALDH1A1POLBL3MBTL1 | |
| SCHEMBL20745291 | 0.85 | HSD17B10 (0.40) | KDM4ECFTRALDH1A1POLBL3MBTL1 | |
| SCHEMBL25359695 | 0.83 | NPSR1 (0.45) | NPSR1KDM4ECFTRALDH1A1PKM | |
| SCHEMBL30475032 | 0.82 | NPSR1 (0.44) | NPSR1KDM4ECFTRALDH1A1L3MBTL1 | |
| SCHEMBL25305744 | 0.82 | NPSR1 (0.44) | NPSR1KDM4ECFTRALDH1A1L3MBTL1 | |
| SCHEMBL23364116 | 0.81 | GAA (0.46) | NPSR1KDM4ECFTRALDH1A1L3MBTL1 | |
| SCHEMBL25096003 | 0.81 | NPSR1 (0.42) | NPSR1KDM4ECFTRALDH1A1L3MBTL1 | |
| SCHEMBL30218091 | 0.81 | NPSR1 (0.42) | NPSR1KDM4ECFTRALDH1A1L3MBTL1 | |
| SCHEMBL25360368 | 0.77 | KDM4E (0.44) | KDM4ECFTRALDH1A1POLBL3MBTL1 | |
| SCHEMBL29824155 | 0.77 | KDM4E (0.44) | KDM4ECFTRALDH1A1POLBL3MBTL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112110918-B | Spiro substituted pyrimido cyclic compounds, process for their preparation and their use in medicine | 劲方医药科技(上海)有限公司 | 2023-08-22 | — | — | CN | disclosed |
| CN-112110918-A | Spiro-substituted pyrimido-cyclic compounds, preparation method and medical application thereof | 劲方医药科技(上海)有限公司 | 2020-12-22 | — | — | CN | disclosed |