Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EIF4E | P06730 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.38 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MYC | P01106 | 1/20 | 0.36 |
| ▸ | MAX | P61244 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.35 |
| ▸ | C1R | P00736 | 1/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | ABCC8 | Q09428 | 2/20 | 0.34 |
| ▸ | KCNJ11 | Q14654 | 2/20 | 0.34 |
| ▸ | MASP2 | O00187 | 1/20 | 0.34 |
| ▸ | F2 | P00734 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28185540 | 0.81 | NPC1 (0.40) | EIF4ECYP1A2CYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL28853237 | 0.78 | ALDH1A1 (0.40) | CYP1A2CYP3A4CYP2C19ALDH1A1MYC | |
| SCHEMBL6371400 | 0.75 | ALDH1A1 (0.53) | EIF4ECYP1A2CYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL28186239 | 0.74 | ALDH1A1 (0.53) | ALDH1A1POLBTDP1L3MBTL1 | |
| SCHEMBL15428680 | 0.74 | DPP4 (0.42) | NOTUMPSMB8HSD11B1C1RSCN9A | |
| SCHEMBL28186260 | 0.74 | MAPT (0.45) | CYP3A4ALDH1A1POLBMYCMAX | |
| SCHEMBL28186241 | 0.74 | NOTUM (0.39) | NOTUMPSMB8ALDH1A1HSD11B1C1R | |
| SCHEMBL7918730 | 0.73 | ABCC1 (0.49) | ALDH1A1MYCTDP1ABCC8KCNJ11 | |
| SCHEMBL27860631 | 0.72 | ALDH1A1 (0.46) | NOTUMPSMB8ALDH1A1POLBC1R | |
| SCHEMBL28185546 | 0.72 | SCN2A (0.44) | EIF4ENOTUMCYP3A4ALDH1A1TDP1 |
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-107382892-A | A kind of preparation technology of the nitro isoxazole compound of 3 aryl 4 | 贵州大学 | 2017-11-24 | — | — | CN | disclosed |