Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28572216 | 0.83 | NR1I2 (0.51) | NR1I2NPSR1RELAKCNH2AOX1 | |
| SCHEMBL25286050 | 0.83 | NR1I2 (0.47) | NR1I2NPSR1RELAKCNH2AOX1 | |
| SCHEMBL1398210 | 0.83 | MAOB (0.44) | ALDH1A1MAPTCYP1A2GLACYP2C9 | |
| SCHEMBL28030371 | 0.80 | TRPA1 (0.42) | ALDH1A1MEN1KMT2ACYP1A2GLA | |
| Ether SCHEMBL16671539 | 0.80 | RELA (0.41) | NR1I2RELAALDH1A1KDM4ECYP1A2 | |
| SCHEMBL28790160 | 0.79 | RELA (0.42) | NR1I2RELAALDH1A1MEN1KMT2A | |
| SCHEMBL1876079 | 0.78 | NR1I2 (0.49) | NR1I2NPSR1RELAKCNH2AOX1 | |
| SCHEMBL1876077 | 0.78 | NR1I2 (0.49) | NR1I2NPSR1RELAKCNH2AOX1 | |
| SCHEMBL28583393 | 0.77 | MAOB (0.44) | NR1I2NPSR1KCNH2AOX1POLB | |
| Triethyl Phosphate SCHEMBL21823232 | 0.77 | NR1I2 (0.54) | NR1I2NPSR1RELAKCNH2AOX1 |
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-107952454-B | Nano catalyst Fe with magnetic core-shell structure3O4@ Te @ Pd and preparation method thereof | 浙江医药高等专科学校 | 2020-10-20 | — | — | CN | disclosed |