Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | HRH1 | P35367 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9452613 | 0.83 | ALDH1A1 (0.46) | ALDH1A1TSHRFDPS | |
| SCHEMBL9323781 | 0.81 | ALDH1A1 (0.46) | ALDH1A1NFKB1FDPS | |
| SCHEMBL7867816 | 0.79 | ALDH1A1 (0.50) | ALDH1A1TSHRFDPS | |
| SCHEMBL1170239 | 0.77 | ALDH1A1 (0.42) | ALDH1A1TSHRCYP3A4NFKB1NPSR1 | |
| SCHEMBL9452624 | 0.75 | — | — | |
| SCHEMBL267634 | 0.74 | — | — | |
| SCHEMBL16907336 | 0.74 | — | — | |
| SCHEMBL7988566 | 0.74 | — | — | |
| SCHEMBL8931943 | 0.72 | — | — | |
| SCHEMBL2799449 | 0.72 | — | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119390948-A | Silicofluorene pterene aromatic ether amine copolymer fluorescent probe and preparation method and application thereof | 湖南华南光电科技股份有限公司 | 2025-02-07 | — | — | CN | disclosed |
| CN-103282769-A | Water quality monitoring apparatus | MIKASA SHOJI CO LTD | 2013-09-04 | — | — | CN | disclosed |
| US-H2257-H1 | Microtags for detection and identification of materials | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 2011-06-07 | — | — | US | disclosed |
| US-7713401-B2 | Methods for performing electrochemical nitration reactions | BATTELLE ENERGY ALLIANCE, LLC (US) | 2010-05-11 | — | — | US | disclosed |
| US-20090038953-A1 | METHODS FOR PERFORMING ELECTROCHEMICAL NITRATION REACTIONS | ENERGY, UNITED STATES DEPARTMENT OF | 2009-02-12 | — | — | US | disclosed |
| WO-2009020798-A1 | METHODS FOR PERFORMING ELECTROCHEMICAL NITRATION REACTIONS | BATTELLE ENERGY ALLIANCE, LLC (US) | 2009-02-12 | — | — | WO | disclosed |
| US-20070072197-A1 | Microtags for detection and identification of materials | NAVY, UNITED STATES OF AMERICA, REPRESENTED BY SEC. OF | 2007-03-29 | — | — | US | disclosed |
| US-20040005676-A1 | Biocatalytic reduction of nitro groups | DIVERSA CORPORATION | 2004-01-08 | — | — | US | disclosed |
| US-4910322-A | Synthesis of geminal dinitro compounds | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) | 1990-03-20 | — | — | US | disclosed |
| US-4774366-A | Synthesis of geminal dinitro compounds | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) | 1988-09-27 | — | — | US | disclosed |
| US-4594430-A | Synthesis of geminal dinitro compounds | UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) | 1986-06-10 | — | — | US | disclosed |
| US-4297501-A | BY REACTING PRIMARY AMINES, CARBON MONOXIDE AND AN ORGANIC ALCOHOL IN THE PRESENCE OF OXYGEN AND A METAL CATALYST SYSTEM | BAYER AKTIENGESELLSCHAFT (DE) | 1981-10-27 | — | — | US | disclosed |