Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSMB5 | P28074 | 4/20 | 0.63 |
| ▸ | CTSB | P07858 | 3/20 | 0.57 |
| ▸ | CTSK | P43235 | 3/20 | 0.57 |
| ▸ | CTSD | P07339 | 3/20 | 0.55 |
| ▸ | KISS1R | Q969F8 | 1/20 | 0.53 |
| ▸ | CAPN1 | P07384 | 3/20 | 0.50 |
| ▸ | CAPN2 | P17655 | 1/20 | 0.50 |
| ▸ | HTRA1 | Q92743 | 1/20 | 0.49 |
| ▸ | FAAH | O00519 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL28525513 | 1.00 | PSMB5 (0.63) | PSMB5CTSBCTSKCTSDKISS1R | |
| SCHEMBL28518104 | 0.89 | PSMB5 (0.68) | PSMB5CTSBCTSDKISS1RFAAH | |
| SCHEMBL28518103 | 0.89 | PSMB5 (0.68) | PSMB5CTSBCTSDKISS1RFAAH | |
| SCHEMBL29535481 | 0.89 | CTSB (0.59) | PSMB5CTSBCTSKCTSDKISS1R | |
| SCHEMBL28523691 | 0.89 | CTSB (0.59) | PSMB5CTSBCTSKCTSDKISS1R | |
| SCHEMBL28518101 | 0.88 | CTSB (0.60) | PSMB5CTSBCTSK | |
| SCHEMBL28518102 | 0.88 | CTSK (0.51) | PSMB5CTSBCTSKCTSDKISS1R | |
| SCHEMBL28517159 | 0.87 | IL1RN (0.60) | CTSBCTSK | |
| SCHEMBL28517158 | 0.87 | IL1RN (0.60) | CTSBCTSK | |
| SCHEMBL9517376 | 0.83 | PSMB5 (0.69) | PSMB5KISS1RFAAH |
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-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 |