Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.31 |
| ▸ | FASN | P49327 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.30 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8774680 | 0.93 | MEN1 (0.35) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL8774687 | 0.93 | MEN1 (0.35) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL8775182 | 0.92 | MAPT (0.37) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL8775186 | 0.92 | MAPT (0.37) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL8774243 | 0.91 | MAPT (0.39) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL8774241 | 0.91 | MAPT (0.39) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL8774429 | 0.90 | TRPV3 (0.36) | IDO1TRPV3FASNS1PR4S1PR1 | |
| SCHEMBL8774421 | 0.90 | TRPV3 (0.36) | IDO1TRPV3FASNS1PR4S1PR1 | |
| SCHEMBL11112346 | 0.88 | CYP2C9 (0.50) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL11112304 | 0.88 | CYP2C9 (0.50) | CYP2C9ALDH1A1MAPTLMNAMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0519370-B1 | Heterocyclic derivatives | MERCK PATENT GMBH (DE) | 1997-11-05 | — | — | EP | disclosed |
| EP-0519370-A2 | Heterocyclic derivatives | MERCK PATENT GmbH (DE) | 1992-12-23 | — | — | EP | disclosed |