Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.40 |
| ▸ | ACACB | O00763 | 1/20 | 0.40 |
| ▸ | CHUK | O15111 | 1/20 | 0.40 |
| ▸ | BRAF | P15056 | 2/20 | 0.39 |
| ▸ | KIT | P10721 | 1/20 | 0.39 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.39 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | PIM3 | Q86V86 | 2/20 | 0.38 |
| ▸ | BAZ2B | Q9UIF8 | 2/20 | 0.38 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.38 |
| ▸ | PIM1 | P11309 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29986202 | 1.00 | AR (0.42) | ARRXFP1DYRK1AACACBCHUK | |
| SCHEMBL29045902 | 1.00 | AR (0.42) | ARRXFP1DYRK1AACACBCHUK | |
| SCHEMBL29045928 | 0.92 | DYRK1A (0.47) | DYRK1AACACBPARP14PIM3L3MBTL1 | |
| SCHEMBL29045926 | 0.92 | DYRK1A (0.47) | DYRK1AACACBPARP14PIM3L3MBTL1 | |
| SCHEMBL29986906 | 0.87 | BCHE (0.49) | RXFP1DYRK1ABRAFPARP14L3MBTL1 | |
| SCHEMBL29045894 | 0.87 | HTR2C (0.44) | DYRK1ABRAFKITPARP14ERBB2 | |
| SCHEMBL29045890 | 0.87 | HTR2C (0.44) | DYRK1ABRAFKITPARP14ERBB2 | |
| SCHEMBL29045901 | 0.87 | BCHE (0.49) | RXFP1DYRK1ABRAFPARP14L3MBTL1 | |
| SCHEMBL29986612 | 0.87 | HTR2C (0.44) | DYRK1ABRAFKITPARP14ERBB2 | |
| SCHEMBL29045899 | 0.87 | BCHE (0.49) | RXFP1DYRK1ABRAFPARP14L3MBTL1 |
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-115304597-B | Beta-carboline compounds and application thereof in preparation of medicines for treating or preventing tumor diseases | 中国科学院深圳先进技术研究院 | 2023-10-20 | — | — | CN | disclosed |
| CN-115304597-A | Beta-carboline compounds and application thereof in preparing medicines for treating or preventing tumor diseases | 中国科学院深圳先进技术研究院 | 2022-11-08 | — | — | CN | disclosed |