Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.39 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.39 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20157960 | 0.85 | SRD5A2 (0.49) | MAPTSRD5A2HTTNPC1MAPK1 | |
| SCHEMBL20157951 | 0.80 | MAPT (0.47) | MAPTSRD5A2HTTNPC1MAPK1 | |
| SCHEMBL20157342 | 0.79 | SRD5A2 (0.43) | MAPTSRD5A2HTTNPC1MAPK1 | |
| SCHEMBL20157973 | 0.78 | SRD5A2 (0.42) | MAPTSRD5A2HTTNPC1MAPK1 | |
| SCHEMBL20157316 | 0.74 | MAPT (0.61) | MAPTHTTNPC1MAPK1ALDH1A1 | |
| SCHEMBL3392851 | 0.73 | CA2 (0.52) | NPC1MAPK1ALDH1A1LMNARAB9A | |
| SCHEMBL21362538 | 0.73 | SRD5A2 (0.39) | MAPTSRD5A2HTTNPC1MAPK1 | |
| SCHEMBL20157816 | 0.73 | MAPT (0.51) | MAPTHTTNPC1MAPK1ALDH1A1 | |
| SCHEMBL20157469 | 0.73 | POLB (0.47) | MAPTSRD5A2HTTNPC1MAPK1 | |
| SCHEMBL658518 | 0.73 | CA2 (0.67) | NPC1ALDH1A1L3MBTL1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018086605-A1 | NITROGENOUS MACROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF | 山东罗欣药业集团股份有限公司 | 2018-05-17 | — | — | WO | disclosed |