Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.62 |
| ▸ | FAAH | O00519 | 2/20 | 0.49 |
| ▸ | CNR1 | P21554 | 2/20 | 0.49 |
| ▸ | CNR2 | P34972 | 2/20 | 0.49 |
| ▸ | SLC15A2 | Q16348 | 1/20 | 0.48 |
| ▸ | REN | P00797 | 8/20 | 0.47 |
| ▸ | CTSB | P07858 | 1/20 | 0.47 |
| ▸ | CTSK | P43235 | 1/20 | 0.47 |
| ▸ | GRPR | P30550 | 1/20 | 0.46 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.46 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL27199088 | 0.94 | SLC6A5 (0.68) | SLC6A5FAAHCNR1CNR2SLC15A2 | |
| SCHEMBL27199097 | 0.94 | SLC6A5 (0.68) | SLC6A5FAAHCNR1CNR2SLC15A2 | |
| SCHEMBL17244043 | 0.92 | SLC6A5 (0.73) | SLC6A5FAAHCNR1CNR2SLC15A2 | |
| SCHEMBL28518101 | 0.87 | CTSB (0.60) | SLC6A5RENCTSBCTSKGRPR | |
| SCHEMBL27199089 | 0.87 | SLC6A5 (0.66) | SLC6A5FAAHCNR1CNR2SLC15A2 | |
| SCHEMBL17244053 | 0.85 | SLC6A5 (0.71) | SLC6A5FAAHCNR1CNR2SLC15A2 | |
| SCHEMBL27199086 | 0.84 | SLC6A5 (0.60) | SLC6A5FAAHCNR1CNR2SLC15A2 | |
| SCHEMBL27199085 | 0.84 | SLC6A5 (0.60) | SLC6A5FAAHCNR1CNR2SLC15A2 | |
| SCHEMBL17817155 | 0.82 | SLC6A5 (0.87) | SLC6A5FAAHCNR1CNR2SLC15A2 | |
| SCHEMBL15649758 | 0.82 | SLC6A5 (0.87) | SLC6A5FAAHCNR1CNR2SLC15A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112279887-A | Amino acid derivative, preparation method and application thereof, anti-tumor micelle and preparation method thereof | 首都医科大学 | 2021-01-29 | — | — | CN | claimed |
| CN-112279887-A | Amino acid derivative, preparation method and application thereof, anti-tumor micelle and preparation method thereof | 首都医科大学 | 2021-01-29 | — | — | CN | disclosed |
| CN-112279887-A | Amino acid derivative, preparation method and application thereof, anti-tumor micelle and preparation method thereof | 首都医科大学 | 2021-01-29 | — | — | CN | disclosed |