Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOD1 | Q9Y239 | 5/20 | 0.56 |
| ▸ | DPP7 | Q9UHL4 | 2/20 | 0.50 |
| ▸ | NAAA | Q02083 | 1/20 | 0.48 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.46 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.43 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.43 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.43 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.43 |
| ▸ | DPP4 | P27487 | 1/20 | 0.42 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.42 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.42 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.42 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8666006 | 0.98 | NOD1 (0.58) | NOD1DPP7NAAASLC15A1EPHX1 | |
| SCHEMBL31029306 | 0.98 | NOD1 (0.58) | NOD1DPP7NAAASLC15A1EPHX1 | |
| SCHEMBL25856290 | 0.94 | NOD1 (0.62) | NOD1DPP7NAAAEPHX1TSHR | |
| SCHEMBL4957809 | 0.94 | NOD1 (0.50) | NOD1DPP7NAAASLC15A1TSHR | |
| SCHEMBL1097461 | 0.94 | NOD1 (0.50) | NOD1DPP7NAAASLC15A1TSHR | |
| SCHEMBL16124533 | 0.92 | NOD1 (0.52) | NOD1DPP7NAAAEPHX1TSHR | |
| SCHEMBL5946309 | 0.91 | NOD1 (0.52) | NOD1DPP7NAAAEPHX1TSHR | |
| SCHEMBL5946307 | 0.91 | NOD1 (0.52) | NOD1DPP7NAAAEPHX1TSHR | |
| SCHEMBL8601166 | 0.90 | NOD1 (0.55) | NOD1DPP7NAAAEPHX1TSHR | |
| SCHEMBL27586212 | 0.90 | NOD1 (0.55) | NOD1DPP7NAAAEPHX1TSHR |
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-111039820-A | Water-soluble antirust agent and preparation method and application thereof | 中国石油天然气股份有限公司 | 2020-04-21 | — | — | CN | disclosed |