Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | PRCP | P42785 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 4/20 | 0.37 |
| ▸ | HTR2C | P28335 | 4/20 | 0.37 |
| ▸ | HTR2B | P41595 | 4/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | L3MBTL4 | Q8NA19 | 1/20 | 0.33 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | GRM7 | Q14831 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL10645737 | 0.83 | KDM1A (0.38) | RAB9AALDH1A1MAOBKDM1A | |
| SCHEMBL30317888 | 0.83 | NOS3 (0.39) | NOS3PRCPHTR2AHTR2CHTR2B | |
| SCHEMBL30317874 | 0.82 | HTR2A (0.41) | HTR2AHTR2CHTR2BHRH3SLC6A3 | |
| SCHEMBL30317872 | 0.79 | CYP19A1 (0.41) | KMT2AL3MBTL1RAB9AMAPTKDM4E | |
| SCHEMBL30317867 | 0.79 | GID4 (0.42) | RAB9AMAPTKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL11133022 | 0.79 | CA1 (0.38) | L3MBTL1RAB9AALDH1A1LMNAMAOB | |
| SCHEMBL4739221 | 0.79 | MAOB (0.35) | KMT2AMAOBKDM1A | |
| SCHEMBL30317889 | 0.76 | HTR2A (0.42) | HTR2AHTR2CHTR2BHRH3KMT2A | |
| SCHEMBL30317887 | 0.76 | HTR2A (0.39) | HTR2AHTR2CHTR2BHRH3GAA | |
| SCHEMBL10812844 | 0.75 | CA1 (0.36) | HRH3RAB9AKDM1A |
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-110680813-B | Use of naphthoquinone derivatives as IDO1 and/or TDO inhibitors | 北京大学 | 2023-03-10 | — | — | CN | disclosed |