Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.38 |
| ▸ | HPGD | P15428 | 5/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.37 |
| ▸ | CDK2 | P24941 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | ALKBH1 | Q13686 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL25171145 | 0.85 | KDM4E (0.37) | HSD17B10KDM4EALDH1A1HPGDMAPT | |
| SCHEMBL28928898 | 0.79 | POLB (0.44) | ALDH1A1MAPTTP53NPSR1TDP1 | |
| SCHEMBL28928890 | 0.79 | POLB (0.34) | KDM4EALDH1A1HPGDMAPTLMNA | |
| SCHEMBL28928915 | 0.79 | KDM4E (0.42) | HSD17B10KDM4EALDH1A1HPGDLMNA | |
| SCHEMBL30184314 | 0.78 | NPC1 (0.43) | HSD17B10KDM4EALDH1A1HPGDMAPT | |
| SCHEMBL28928923 | 0.77 | NPC1 (0.48) | HSD17B10KDM4EALDH1A1HPGDMAPT | |
| SCHEMBL28928908 | 0.76 | KDM4E (0.38) | HSD17B10KDM4EALDH1A1HPGDLMNA | |
| SCHEMBL25118135 | 0.75 | KDM4E (0.43) | HSD17B10KDM4EALDH1A1HPGDMAPT | |
| SCHEMBL25170456 | 0.73 | KDM4E (0.46) | HSD17B10KDM4EALDH1A1HPGDMAPT | |
| SCHEMBL25117842 | 0.73 | MAPT (0.48) | KDM4EALDH1A1HPGDMAPTCCNA2 |
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-116063325-A | Macrocyclic compounds with BTK modulating effect and uses thereof | 赛诺哈勃药业（成都）有限公司 | 2023-05-05 | — | — | CN | disclosed |