Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 4/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 4/20 | 0.36 |
| ▸ | CTSC | P53634 | 7/20 | 0.36 |
| ▸ | CTSK | P43235 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.33 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL24981066 | 0.81 | CTSK (0.46) | NR1H2CTSCCTSKNR1H3 | |
| SCHEMBL29455573 | 0.81 | CTSK (0.46) | NR1H2CTSCCTSKNR1H3 | |
| SCHEMBL28989337 | 0.81 | CTSK (0.46) | NR1H2CTSCCTSKNR1H3 | |
| SCHEMBL28989780 | 0.78 | CTSC (0.54) | CTSCCTSK | |
| SCHEMBL28989367 | 0.78 | CTSC (0.50) | CTSCCTSK | |
| SCHEMBL28989260 | 0.78 | KMT2A (0.39) | APPNR1H2CTSCCTSKKMT2A | |
| SCHEMBL28989261 | 0.78 | KMT2A (0.39) | APPNR1H2CTSCCTSKKMT2A | |
| SCHEMBL28989680 | 0.77 | MAPT (0.42) | KMT2APOLB | |
| SCHEMBL24981065 | 0.77 | KMT2A (0.45) | APPNR1H2CTSCCTSKKMT2A | |
| SCHEMBL28989399 | 0.77 | KMT2A (0.45) | APPNR1H2CTSCCTSKKMT2A |
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-115996923-A | Nitrile derivative as dipeptidyl peptidase 1 inhibitor and application thereof | 四川海思科制药有限公司 | 2023-04-21 | — | — | CN | disclosed |