Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MPO | P05164 | 4/20 | 0.55 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.53 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | DRD2 | P14416 | 1/20 | 0.48 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.48 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | CA3 | P07451 | 1/20 | 0.46 |
| ▸ | CA4 | P22748 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL987688 | 0.94 | MPO (0.60) | MPOKEAP1TAAR1PKMHTR1A | |
| Water SCHEMBL27860759 | 0.91 | MPO (0.58) | MPOKEAP1TAAR1PKMHTR1A | |
| SCHEMBL30468688 | 0.91 | MPO (0.58) | MPOKEAP1TAAR1PKMHTR1A | |
| Potassium SCHEMBL30848210 | 0.91 | MPO (0.58) | MPOKEAP1TAAR1PKMHTR1A | |
| SCHEMBL3625458 | 0.89 | KEAP1 (0.67) | MPOKEAP1TAAR1HSPA5ESR1 | |
| Formaldehyde SCHEMBL17311199 | 0.88 | MPO (0.55) | MPOTAAR1PKMHSPA5AKR1B1 | |
| Phenol SCHEMBL7706143 | 0.84 | TDP1 (0.65) | TAAR1ESR1ESR2CA12CA1 | |
| Oxirane SCHEMBL28030424 | 0.84 | MPO (0.51) | MPOTAAR1PKMHTR1ADRD2 | |
| Phenol SCHEMBL7044426 | 0.82 | TDP1 (0.61) | TAAR1ESR1ESR2CA12CA1 | |
| SCHEMBL29706272 | 0.82 | TAAR1 (0.71) | MPOTAAR1HTR1AHSPA5AKR1B1 |
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-109964934-A | A kind of mixed easily decomposing pesticide EC compound dosage form and preparation method thereof of high-content | 江苏艾津农化有限责任公司 | 2019-07-05 | — | — | CN | claimed |
| CN-109964934-A | A kind of mixed easily decomposing pesticide EC compound dosage form and preparation method thereof of high-content | 江苏艾津农化有限责任公司 | 2019-07-05 | — | — | CN | disclosed |