Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSG | P08311 | 1/20 | 0.35 |
| ▸ | CMA1 | P23946 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.33 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | MMP8 | P22894 | 1/20 | 0.32 |
| ▸ | MMP12 | P39900 | 1/20 | 0.32 |
| ▸ | MMP14 | P50281 | 1/20 | 0.32 |
| ▸ | CTSS | P25774 | 1/20 | 0.32 |
| ▸ | CTSK | P43235 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21896476 | 1.00 | CTSG (0.35) | CTSGCMA1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL21895861 | 0.87 | CTSS (0.43) | CTSGCMA1CTSSCTSKSMN1; SMN2 | |
| SCHEMBL21895863 | 0.87 | CTSS (0.43) | CTSGCMA1CTSSCTSKSMN1; SMN2 | |
| SCHEMBL21952404 | 0.86 | ALDH1A1 (0.42) | CTSGCMA1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL28362291 | 0.85 | CNR2 (0.36) | CTSSCTSKKMT2A | |
| SCHEMBL21950780 | 0.85 | CNR2 (0.36) | CTSSCTSKKMT2A | |
| SCHEMBL28366266 | 0.85 | CTSL (0.39) | ALDH1A1CTSSCTSKKMT2AHPGD | |
| SCHEMBL21895954 | 0.85 | CTSL (0.39) | ALDH1A1CTSSCTSKKMT2AHPGD | |
| SCHEMBL21837384 | 0.82 | FOLH1 (0.45) | CTSGCMA1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL21837383 | 0.82 | FOLH1 (0.45) | CTSGCMA1SLC6A2SLC6A4SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110869544-B | Cyclic peptide compound having high membrane permeability and library comprising same | 中外制药株式会社 | 2024-03-08 | — | — | CN | disclosed |
| CN-110869544-A | Cyclic peptide compound having high membrane permeability and library containing same | 中外制药株式会社 | 2020-03-06 | — | — | CN | disclosed |