Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 4/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MIF | P14174 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | SRD5A2 | P31213 | 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 | |
|---|---|---|---|---|
| SCHEMBL28743578 | 1.00 | IDO1 (0.48) | IDO1TAAR1MAOBALDH1A1KDM4E | |
| SCHEMBL27609898 | 0.79 | IDO1 (0.48) | IDO1TAAR1MAOBALDH1A1KDM4E | |
| SCHEMBL28348088 | 0.79 | IDO1 (0.53) | IDO1TAAR1MAOBALDH1A1KDM4E | |
| SCHEMBL28743735 | 0.79 | TSHR (0.43) | — | |
| SCHEMBL28225197 | 0.79 | TSHR (0.43) | — | |
| SCHEMBL24258373 | 0.79 | IDO1 (0.53) | IDO1TAAR1MAOBALDH1A1KDM4E | |
| SCHEMBL1044976 | 0.78 | IDO1 (0.47) | IDO1TAAR1MAOBALDH1A1KDM4E | |
| SCHEMBL1044978 | 0.78 | IDO1 (0.47) | IDO1TAAR1MAOBALDH1A1KDM4E | |
| SCHEMBL28743534 | 0.77 | IDO1 (0.54) | IDO1TAAR1MAOBALDH1A1KDM4E | |
| SCHEMBL28743537 | 0.77 | IDO1 (0.54) | IDO1TAAR1MAOBALDH1A1KDM4E |
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-108101826-B | Indole-substituted alkylamine compound and application thereof | 华东理工大学 | 2022-05-10 | — | — | CN | disclosed |