Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.70 |
| ▸ | TSHR | P16473 | 5/20 | 0.49 |
| ▸ | FAAH | O00519 | 1/20 | 0.49 |
| ▸ | CES2 | O00748 | 3/20 | 0.45 |
| ▸ | CES1 | P23141 | 3/20 | 0.45 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.43 |
| ▸ | PPARG | P37231 | 6/20 | 0.43 |
| ▸ | PPARD | Q03181 | 6/20 | 0.43 |
| ▸ | PPARA | Q07869 | 6/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.43 |
| ▸ | TLR2 | O60603 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | FABP4 | P15090 | 2/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.43 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.43 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | PDE4A | P27815 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4019233 | 1.00 | ALDH1A1 (0.70) | ALDH1A1TSHRFAAHCES2CES1 | |
| SCHEMBL570411 | 1.00 | ALDH1A1 (0.70) | ALDH1A1TSHRFAAHCES2CES1 | |
| SCHEMBL4243964 | 1.00 | ALDH1A1 (0.70) | ALDH1A1TSHRFAAHCES2CES1 | |
| SCHEMBL30763455 | 1.00 | ALDH1A1 (0.70) | ALDH1A1TSHRFAAHCES2CES1 | |
| SCHEMBL11564777 | 1.00 | ALDH1A1 (0.70) | ALDH1A1TSHRFAAHCES2CES1 | |
| SCHEMBL30763459 | 1.00 | ALDH1A1 (0.70) | ALDH1A1TSHRFAAHCES2CES1 | |
| SCHEMBL568962 | 0.98 | ALDH1A1 (0.73) | ALDH1A1TSHRFAAHCES2CES1 | |
| SCHEMBL7710302 | 0.92 | ALDH1A1 (0.59) | ALDH1A1FAAHPPARGPPARDPPARA | |
| SCHEMBL11545896 | 0.92 | ALDH1A1 (0.59) | ALDH1A1FAAHPPARGPPARDPPARA | |
| SCHEMBL20881785 | 0.91 | ALDH1A1 (0.58) | ALDH1A1TSHRFAAHCES2CES1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007034511-A3 | NOVEL SOLUBILITY ENHANCER AND USE THEREOF | RADHAKRISHNAN RAMACHANDRAN (IN) | 2009-04-09 | — | — | WO | disclosed |
| WO-2007034511-A2 | NOVEL SOLUBILITY ENHANCER AND USE THEREOF | RADHAKRISHNAN RAMACHANDRAN (IN) | 2007-03-29 | — | — | WO | disclosed |
| US-6579514-B1 | Antimicrobial betaine and tertiary amine oxide surfactant; alcohol-free; teeth extraction | ORATEC CORP. | 2003-06-17 | — | — | US | disclosed |