Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | SLC15A2 | Q16348 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.36 |
| ▸ | GGT1 | P19440 | 1/20 | 0.35 |
| ▸ | NAALAD2 | Q9Y3Q0 | 1/20 | 0.34 |
| ▸ | ARG1 | P05089 | 2/20 | 0.32 |
| ▸ | ARG2 | P78540 | 2/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | KDM6B | O15054 | 1/20 | 0.31 |
| ▸ | KDM5C | P41229 | 1/20 | 0.31 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.31 |
| ▸ | PHF8 | Q9UPP1 | 1/20 | 0.31 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL497168 | 0.79 | THRB (0.54) | ALDH1A1LMNASLC15A2MEN1CYP1A2 | |
| Hydrochloric Acid SCHEMBL28548595 | 0.77 | THRB (0.52) | ALDH1A1LMNAMEN1CYP1A2THRB | |
| SCHEMBL10752660 | 0.77 | KMT2A (0.37) | ALDH1A1LMNAMEN1CYP1A2THRB | |
| SCHEMBL12113226 | 0.76 | ALDH1A1 (0.50) | ALDH1A1LMNASLC15A2MEN1CYP1A2 | |
| Hydrochloric Acid SCHEMBL28357414 | 0.75 | KMT2A (0.35) | ALDH1A1LMNAMEN1CYP1A2THRB | |
| SCHEMBL6276371 | 0.75 | ALDH1A1 (0.38) | ALDH1A1LMNASLC15A2MEN1CYP1A2 | |
| SCHEMBL191307 | 0.74 | — | — | |
| SCHEMBL1521279 | 0.74 | TSHR (0.36) | ALDH1A1LMNASLC15A2MEN1CYP1A2 | |
| SCHEMBL21983371 | 0.73 | LMNA (0.52) | ALDH1A1LMNASLC15A2MEN1CYP1A2 | |
| SCHEMBL7390678 | 0.72 | GGT1 (0.41) | ALDH1A1MEN1CYP1A2THRBKMT2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112501102-B | Escherichia coli recombinant bacterium for efficiently producing tetrahydropyrimidine | 江南大学 | 2022-10-11 | — | — | CN | disclosed |
| US-20210147900-A1 | METHODS AND COMPOSITIONS FOR DETECTING BETA-HYDROXYBUTYRATE IN BIOLOGICAL FLUIDS | F.A.T. Stats LLC | 2021-05-20 | — | — | US | disclosed |
| US-9673030-B2 | Computer readable storage mediums, methods and systems for normalizing chemical profiles in biological or medical samples detected by mass spectrometry | EMORY UNIVERSITY (US) | 2017-06-06 | — | — | US | disclosed |
| US-20110282587-A1 | COMPUTER READABLE STORAGE MEDIUMS, METHODS AND SYSTEMS FOR NORMALIZING CHEMICAL PROFILES IN BIOLOGICAL OR MEDICAL SAMPLES DETECTED BY MASS SPECTROMETRY | EMORY UNIVERSITY (US) | 2011-11-17 | — | — | US | disclosed |
| US-20110129893-A1 | MONITORING TARGET ENDOGENOUS SPECIES | NATIONAL UNIVERSTIY OF IRELAND, MAYNOOTH (IE) | 2011-06-02 | — | — | US | disclosed |