Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 4/20 | 0.33 |
| ▸ | TDO2 | P48775 | 4/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27757169 | 0.76 | IDO1 (0.39) | IDO1TDO2MEN1KMT2AGPR55 | |
| SCHEMBL27742901 | 0.76 | SLC6A2 (0.32) | PARP1 | |
| SCHEMBL28290102 | 0.72 | IDO1 (0.35) | IDO1TDO2HTTPARP1MEN1 | |
| SCHEMBL858 | 0.71 | CYP2D6 (0.42) | IDO1TDO2MAPK1HTTKMT2A | |
| SCHEMBL27934677 | 0.70 | L3MBTL1 (0.35) | IDO1TDO2MAPK1HTT | |
| SCHEMBL27920982 | 0.69 | MEN1 (0.33) | IDO1TDO2MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL10708013 | 0.69 | HTT (0.44) | IDO1TDO2MAPK1HTTMEN1 | |
| SCHEMBL28330269 | 0.68 | IDO1 (0.36) | IDO1TDO2MEN1KMT2AGPR55 | |
| SCHEMBL8391285 | 0.66 | PARP1 (0.34) | PARP1 | |
| Cyclopropane SCHEMBL28325005 | 0.66 | CYP2D6 (0.38) | IDO1TDO2MAPK1HTTMEN1 |
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-105461629-A | Preparation method of 3-fluoroalkyl-1H-pyrazole-4-formic ester | UNIV TIANJIN | 2016-04-06 | — | — | CN | disclosed |