Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | GID4 | Q8IVV7 | 1/20 | 0.46 |
| ▸ | HTR2C | P28335 | 4/20 | 0.42 |
| ▸ | HTR2A | P28223 | 2/20 | 0.40 |
| ▸ | HTR2B | P41595 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL30317867 | 0.84 | GID4 (0.42) | GID4ALDH1A1MAPTKDM1AKDM4E | |
| SCHEMBL13350266 | 0.81 | SLC6A2 (0.43) | LMNAHTR2AKDM1ACYP19A1DRD2 | |
| SCHEMBL30317856 | 0.78 | FAAH (0.35) | — | |
| SCHEMBL30317874 | 0.78 | HTR2A (0.41) | HTR2CHTR2AHTR2B | |
| SCHEMBL30317866 | 0.72 | LMNA (0.48) | LMNAHTR2CHTR2AHTR2BKMT2A | |
| SCHEMBL30317872 | 0.72 | CYP19A1 (0.41) | KMT2AALDH1A1MAPTADRA1ACYP19A1 | |
| SCHEMBL30317894 | 0.72 | HTR2C (0.41) | HTR2CHTR2AHTR2BKMT2AADRA1A | |
| SCHEMBL8865153 | 0.72 | GID4 (0.46) | LMNAGID4HTR2CHTR2AHTR2B | |
| SCHEMBL30317851 | 0.71 | TRPA1 (0.33) | — | |
| SCHEMBL30317880 | 0.71 | FAAH (0.32) | — |
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 |