Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | TDO2 | P48775 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22603159 | 0.74 | CYP1A2 (0.38) | ALDH1A1IDO1TDO2 | |
| SCHEMBL9821731 | 0.73 | MEN1 (0.37) | CYP2D6ALDH1A1KCNH2 | |
| SCHEMBL28375696 | 0.72 | OPRD1 (0.44) | ALDH1A1LMNAMAPK1 | |
| SCHEMBL1615464 | 0.72 | PRCP (0.38) | CYP2D6 | |
| SCHEMBL19457862 | 0.71 | F12 (0.37) | ALDH1A1IDO1TDO2 | |
| SCHEMBL3749720 | 0.70 | ALDH1A1 (0.57) | ALDH1A1KCNH2 | |
| SCHEMBL5800011 | 0.70 | ALDH1A1 (0.57) | ALDH1A1KCNH2 | |
| SCHEMBL18547313 | 0.70 | SLC6A4 (0.53) | CYP2D6SRCSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL2605810 | 0.70 | CCKBR (0.41) | ALDH1A1IDO1TDO2 | |
| SCHEMBL3258002 | 0.70 | IDO1 (0.50) | ALDH1A1IDO1TDO2 |
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-105753764-A | Indoline-3-carboxylic acid derivatives and application thereof in pharmaceuticals | 贵州医科大学 | 2016-07-13 | — | — | CN | disclosed |