Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 8/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CRHBP | P24387 | 1/20 | 0.43 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | TTR | P02766 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL7908796 | 0.89 | GPR35 (0.54) | GPR35ALDH1A1CA12CA1CA2 | |
| SCHEMBL24711215 | 0.81 | MAPK1 (0.50) | GPR35ALDH1A1CA12CA1CA2 | |
| SCHEMBL19497421 | 0.81 | GPR35 (0.78) | GPR35ALDH1A1CRHBPCRHR2CA12 | |
| SCHEMBL69563 | 0.81 | GPR35 (1.00) | GPR35ALDH1A1CRHBPCRHR2CA12 | |
| SCHEMBL690829 | 0.81 | GPR35 (0.78) | GPR35ALDH1A1CRHBPCRHR2CA12 | |
| SCHEMBL28002150 | 0.79 | GPR35 (0.43) | GPR35ALDH1A1CRHBPCRHR2MEN1 | |
| SCHEMBL28573264 | 0.77 | GPR35 (0.47) | GPR35ALDH1A1CRHBPCRHR2CA12 | |
| SCHEMBL7028676 | 0.76 | GPR35 (0.74) | GPR35ALDH1A1CRHBPCRHR2ESR1 | |
| SCHEMBL15851029 | 0.75 | GPR35 (0.68) | GPR35ALDH1A1CRHBPCRHR2CA12 | |
| SCHEMBL15157099 | 0.75 | TSHR (0.53) | GPR35ALDH1A1MEN1KMT2AMAPK1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112661649-B | 2,6-dinitro-4-tert-amylphenol and preparation method thereof | 宁波龙欣精细化工有限公司 | 2023-01-10 | — | — | CN | claimed |
| CN-112661649-A | 2, 6-dinitro-4-tert-amylphenol and preparation method thereof | 宁波龙欣精细化工有限公司 | 2021-04-16 | — | — | CN | claimed |
| CN-112661649-B | 2,6-dinitro-4-tert-amylphenol and preparation method thereof | 宁波龙欣精细化工有限公司 | 2023-01-10 | — | — | CN | disclosed |
| CN-112661649-B | 2,6-dinitro-4-tert-amylphenol and preparation method thereof | 宁波龙欣精细化工有限公司 | 2023-01-10 | — | — | CN | disclosed |
| CN-112661649-B | 2,6-dinitro-4-tert-amylphenol and preparation method thereof | 宁波龙欣精细化工有限公司 | 2023-01-10 | — | — | CN | disclosed |
| CN-112661649-A | 2, 6-dinitro-4-tert-amylphenol and preparation method thereof | 宁波龙欣精细化工有限公司 | 2021-04-16 | — | — | CN | disclosed |
| CN-112661649-A | 2, 6-dinitro-4-tert-amylphenol and preparation method thereof | 宁波龙欣精细化工有限公司 | 2021-04-16 | — | — | CN | disclosed |
| CN-112661649-A | 2, 6-dinitro-4-tert-amylphenol and preparation method thereof | 宁波龙欣精细化工有限公司 | 2021-04-16 | — | — | CN | disclosed |