Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.42 |
| ▸ | HTR2B | P41595 | 2/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.39 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.39 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20443883 | 0.82 | ADRA1A (0.45) | ADRA1ALMNASLC6A2HTR2BTRPA1 | |
| SCHEMBL18379847 | 0.81 | EIF4A3 (0.37) | ADRA1ALMNASLC6A2HTR2BTRPA1 | |
| SCHEMBL19304091 | 0.80 | CA3 (0.34) | ADRA1AGABRA1GABRB2ADRB2ADRB1 | |
| SCHEMBL15631302 | 0.80 | ADRA1A (0.57) | ADRA1ALMNASLC6A2HTR2BTRPA1 | |
| SCHEMBL478565 | 0.79 | LMNA (0.46) | ADRA1ALMNASLC6A2HTR2BTRPA1 | |
| SCHEMBL24681025 | 0.78 | TRPA1 (0.42) | ADRA1ALMNASLC6A2HTR2BTRPA1 | |
| SCHEMBL6679675 | 0.77 | GABRA1 (0.52) | ADRA1ALMNASLC6A2HTR2BTRPA1 | |
| SCHEMBL16527874 | 0.77 | LMNA (0.45) | ADRA1ALMNASLC6A2HTR2BTRPA1 | |
| SCHEMBL17190308 | 0.77 | ANPEP (0.35) | ADRA1ALMNASLC6A2HTR2BTRPA1 | |
| SCHEMBL16132833 | 0.77 | CYP3A4 (0.38) | LMNAGABRA1GABRB2ADRB2ADRB1 |
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-103896744-A | 2,6-diisopropyl-3-fluorophenol as well as preparation method and application thereof | SICHUAN HAISCO PHARMACEUTICAL CO LTD | 2014-07-02 | — | — | CN | claimed |
| CN-103896744-A | 2,6-diisopropyl-3-fluorophenol as well as preparation method and application thereof | SICHUAN HAISCO PHARMACEUTICAL CO LTD | 2014-07-02 | — | — | CN | disclosed |