Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSL | P07711 | 1/20 | 0.51 |
| ▸ | CTSB | P07858 | 1/20 | 0.51 |
| ▸ | CTSK | P43235 | 1/20 | 0.51 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL12719794 | 0.81 | ALOX15 (0.52) | — | |
| SCHEMBL18461976 | 0.79 | CHRM2 (0.59) | CTSLCTSBCTSKCHRM2CHRM1 | |
| SCHEMBL4054424 | 0.77 | CTSL (0.44) | CTSLCTSBCTSKCHRM2CHRM1 | |
| SCHEMBL4869078 | 0.75 | CTSL (0.47) | CTSLCTSBCTSKLMNA | |
| SCHEMBL4869082 | 0.75 | CTSL (0.47) | CTSLCTSBCTSKLMNA | |
| SCHEMBL29076932 | 0.74 | L3MBTL1 (0.53) | CTSLCTSBCTSK | |
| SCHEMBL29076936 | 0.74 | L3MBTL1 (0.53) | CTSLCTSBCTSK | |
| SCHEMBL25974542 | 0.74 | BRD4 (0.44) | LMNA | |
| SCHEMBL337537 | 0.74 | BUB1 (0.51) | CTSLCTSBCTSKLMNA | |
| SCHEMBL20666477 | 0.74 | BRD4 (0.38) | CTSLCTSBCTSKLMNA |
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-109843889-A | Spiral shell-lactams NMDA regulator and the method for using it | 阿普廷伊克斯股份有限公司 | 2019-06-04 | — | — | CN | disclosed |