Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 2/20 | 0.40 |
| ▸ | NOS2 | P35228 | 2/20 | 0.40 |
| ▸ | NOS1 | P29475 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | PGK1 | P00558 | 1/20 | 0.32 |
| ▸ | PGK2 | P07205 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.31 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.31 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.31 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.31 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | CASP7 | P55210 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | DHFR | P00374 | 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 | |
|---|---|---|---|---|
| Malonic Acid SCHEMBL28444898 | 0.87 | NPSR1 (0.44) | NOS3NOS2NOS1NPSR1ALDH1A1 | |
| SCHEMBL168554 | 0.83 | GRIN2D (0.36) | NOS3NOS2NOS1GRIN2DGRIN3B | |
| SCHEMBL28347480 | 0.82 | PGK1 (0.40) | NOS3NOS2NOS1NPSR1PGK1 | |
| SCHEMBL3965381 | 0.82 | NOS3 (0.34) | NOS3NOS2NOS1NPSR1PGK1 | |
| Ammonia Solution, Strong SCHEMBL27455415 | 0.80 | GRIN2D (0.35) | NOS3NOS2NOS1ALDH1A1GRIN2D | |
| SCHEMBL5178615 | 0.80 | GRIN2D (0.35) | NOS3NOS2NOS1GRIN2DGRIN3B | |
| SCHEMBL25329204 | 0.78 | ESR1 (0.40) | NPSR1ALOX15 | |
| SCHEMBL30523835 | 0.78 | ESR1 (0.40) | NPSR1ALOX15 | |
| SCHEMBL27592078 | 0.78 | SIRT1 (0.37) | NOS3NOS2NOS1NPSR1ALDH1A1 | |
| SCHEMBL30523803 | 0.78 | KDM4E (0.40) | NPSR1PGK1PGK2ALDH1A1CYP1A2 |
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-105085576-B | A kind of pyridine amido chromium complex and its preparation method and application | 华东理工大学 | 2017-12-22 | — | — | CN | disclosed |
| CN-105085576-A | Pyridinamine-based chromium complex and preparation method and application thereof | UNIV EAST CHINA SCIENCE & TECH | 2015-11-25 | — | — | CN | disclosed |
| EP-1053990-A2 | A method of producing an aromatic ketone and an aromatic ketone composition containing it | TORAY INDUSTRIES, INC. (JP) | 2000-11-22 | — | — | EP | disclosed |
| EP-0414207-B1 | Method for preparing alpha-(-4-isobutylphenyl) propionic acid or its precursor | NIPPON PETROCHEMICALS CO LTD (JP) | 1994-08-03 | — | — | EP | disclosed |
| US-5235115-A | Selective ethylation of 2-alkoxy-naphthalene compounds | AMOCO CORPORATION (US) | 1993-08-10 | — | — | US | disclosed |
| US-5166419-A | Multistage reaction by catalytic dehydrogenation and reaction with carbon monoxide | NIPPON PETROCHEMICALS CO., LTD. (JP) | 1992-11-24 | — | — | US | disclosed |
| EP-0414207-A2 | Method for preparing alpha-(-4-isobutylphenyl) propionic acid or its precursor | NIPPON PETROCHEMICALS CO., LTD. (JP) | 1991-02-27 | — | — | EP | disclosed |
| US-4446329-A | METAL SALT OF PERFLUOROSULFONIC ACID POLYMER CATALYST | E. I. DU PONT DE NEMOURS & COMPANY (US) | 1984-05-01 | — | — | US | disclosed |