Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSR | P00390 | 1/20 | 0.71 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CPA1 | P15085 | 3/20 | 0.42 |
| ▸ | CNR1 | P21554 | 6/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14746522 | 0.84 | GSR (0.55) | GSRNPC1ADAM17KDM4EMAPT | |
| SCHEMBL28215784 | 0.83 | GSR (0.69) | GSRNPC1ADAM17KDM4EMAPT | |
| SCHEMBL27319378 | 0.83 | GSR (0.69) | GSRNPC1ADAM17MEN1POLB | |
| SCHEMBL9803273 | 0.81 | GSR (0.67) | GSRNPC1ADAM17KDM4EMAPT | |
| SCHEMBL28958827 | 0.80 | GSR (0.65) | GSRNPC1ADAM17KDM4EMAPT | |
| SCHEMBL28885399 | 0.80 | GSR (0.65) | GSRNPC1ADAM17KDM4EMAPT | |
| SCHEMBL5983522 | 0.78 | GSR (0.49) | GSRNPC1ADAM17KDM4EMAPT | |
| SCHEMBL9202581 | 0.77 | NPC1 (0.56) | NPC1ADAM17KDM4EMAPTMAPK1 | |
| SCHEMBL11661255 | 0.77 | GSR (0.51) | GSRNPC1ADAM17KDM4EMAPT | |
| SCHEMBL28347264 | 0.76 | GSR (0.59) | GSRNPC1ADAM17MAPTNPSR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105111086-A | 1-phenyl-2-nitroethanol and preparation method of derivatives thereof | UNIV NANJING INF SCI & TECH | 2015-12-02 | — | — | CN | claimed |
| CN-105111086-A | 1-phenyl-2-nitroethanol and preparation method of derivatives thereof | UNIV NANJING INF SCI & TECH | 2015-12-02 | — | — | CN | disclosed |