Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.68 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.54 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.54 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.54 |
| ▸ | LCK | P06239 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | ABL1 | P00519 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.50 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.50 |
| ▸ | MMP2 | P08253 | 2/20 | 0.46 |
| ▸ | MMP12 | P39900 | 2/20 | 0.46 |
| ▸ | MMP8 | P22894 | 1/20 | 0.46 |
| ▸ | MMP13 | P45452 | 1/20 | 0.46 |
| ▸ | MMP14 | P50281 | 1/20 | 0.46 |
| ▸ | MMP16 | P51512 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7322443 | 1.00 | HSD17B10 (0.68) | HSD17B10AKR1C2AKR1C3PTGS1KDM4E | |
| SCHEMBL7144108 | 0.88 | HSD17B10 (0.51) | HSD17B10AKR1C2AKR1C3PTGS1KDM4E | |
| SCHEMBL7308036 | 0.86 | HSD17B10 (0.50) | HSD17B10AKR1C2AKR1C3PTGS1KDM4E | |
| SCHEMBL7307333 | 0.85 | HSD17B10 (0.49) | HSD17B10AKR1C2AKR1C3PTGS1KDM4E | |
| SCHEMBL8589029 | 0.83 | HSD17B10 (0.47) | HSD17B10KDM4EPOLBABL1MAPT | |
| SCHEMBL10962956 | 0.83 | AKR1C3 (0.52) | HSD17B10AKR1C2AKR1C3PTGS1 | |
| SCHEMBL7314187 | 0.83 | POLB (0.65) | HSD17B10KDM4EPOLBMAPTLMNA | |
| SCHEMBL10411874 | 0.82 | ALDH1A1 (0.47) | HSD17B10AKR1C2AKR1C3PTGS1POLB | |
| SCHEMBL21232836 | 0.81 | PPARG (0.46) | HSD17B10KDM4EMAPTLMNAALDH1A1 | |
| SCHEMBL15935612 | 0.81 | HSD17B10 (0.70) | HSD17B10AKR1C2AKR1C3PTGS1KDM4E |
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-116332910-A | 2-aminopyrimidine derivatives as kinase inhibitors, preparation and use thereof | 江苏威凯尔医药科技有限公司 | 2023-06-27 | — | — | CN | disclosed |