Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | HTR2B | P41595 | 1/20 | 0.42 |
| ▸ | HTR5A | P47898 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ACACB | O00763 | 3/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | BRAF | P15056 | 1/20 | 0.37 |
| ▸ | GABRP | O00591 | 1/20 | 0.36 |
| ▸ | GABRD | O14764 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29986913 | 1.00 | HTR2C (0.42) | HTR2CHTR2BHTR5AMAOAPARP14 | |
| SCHEMBL29045912 | 1.00 | HTR2C (0.42) | HTR2CHTR2BHTR5AMAOAPARP14 | |
| SCHEMBL29985624 | 0.89 | MEN1 (0.39) | MAOAPARP14MEN1POLBMAPT | |
| SCHEMBL29045915 | 0.89 | MEN1 (0.39) | MAOAPARP14MEN1POLBMAPT | |
| SCHEMBL29045910 | 0.89 | MEN1 (0.39) | MAOAPARP14MEN1POLBMAPT | |
| SCHEMBL29045883 | 0.89 | PARP14 (0.48) | HTR2BHTR5AMAOAPARP14MEN1 | |
| SCHEMBL29045911 | 0.87 | BCHE (0.52) | HTR2CHTR2BHTR5AMEN1POLB | |
| SCHEMBL29045916 | 0.87 | BCHE (0.52) | HTR2CHTR2BHTR5AMEN1POLB | |
| SCHEMBL29986500 | 0.87 | BCHE (0.52) | HTR2CHTR2BHTR5AMEN1POLB | |
| SCHEMBL29045894 | 0.82 | HTR2C (0.44) | HTR2CHTR2BHTR5APARP14L3MBTL1 |
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-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 |