Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 5/20 | 0.54 |
| ▸ | CTSK | P43235 | 5/20 | 0.54 |
| ▸ | CTSD | P07339 | 1/20 | 0.49 |
| ▸ | REN | P00797 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | ACE | P12821 | 2/20 | 0.46 |
| ▸ | MME | P08473 | 1/20 | 0.46 |
| ▸ | CPA1 | P15085 | 1/20 | 0.46 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.46 |
| ▸ | OPRD1 | P41143 | 5/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.45 |
| ▸ | CCKBR | P32239 | 3/20 | 0.45 |
| ▸ | CCKAR | P32238 | 3/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL29472199 | 0.90 | F2 (0.48) | CTSSCTSKCTSDOPRD1OPRM1 | |
| SCHEMBL29472204 | 0.88 | CTSS (0.60) | CTSSCTSKCTSDRENCA2 | |
| SCHEMBL30211356 | 0.88 | NPY4R (0.50) | OPRD1OPRM1CCKBRCCKAR | |
| SCHEMBL31069957 | 0.87 | CTSS (0.52) | CTSSCTSKCTSDRENCA2 | |
| SCHEMBL30104127 | 0.87 | ACE (0.52) | ACEMMECPA1ACE2OPRD1 | |
| SCHEMBL31069959 | 0.86 | CTSS (0.50) | CTSSCTSKCTSDRENOPRD1 | |
| SCHEMBL31069955 | 0.85 | OPRD1 (0.51) | CTSSCTSKRENOPRD1OPRM1 | |
| SCHEMBL31181954 | 0.85 | CTSS (0.52) | CTSSCTSKCTSDCA2OPRD1 | |
| SCHEMBL31069950 | 0.85 | ACE (0.56) | CTSSCTSKCTSDRENCA2 | |
| SCHEMBL31069951 | 0.84 | OPRD1 (0.49) | CTSSCTSKRENOPRD1OPRM1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115353546-B | Preparation and application of oligopeptide modified bisindolylethyl-beta-carboline-3-carboxylic acid | 首都医科大学 | 2024-10-08 | — | — | CN | disclosed |
| CN-115353546-A | Preparation and application of oligopeptide-modified bis-indolylethyl-beta-carboline-3-carboxylic acid | 首都医科大学 | 2022-11-18 | — | — | CN | disclosed |
| CN-109134605-B | 1, 1-dihydroxymethyl-tetrahydro-beta-carboline-3-formyl-GYIGSK, and synthesis, activity and application thereof | 首都医科大学 | 2022-04-22 | — | — | CN | disclosed |
| CN-109134603-B | 1, 1-dihydroxymethyl-tetrahydro-beta-carboline-3-formyl-GYIGSR, and synthesis, activity and application thereof | 首都医科大学 | 2022-04-22 | — | — | CN | disclosed |