Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | CES2 | O00748 | 4/20 | 0.48 |
| ▸ | CES1 | P23141 | 4/20 | 0.48 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.46 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.44 |
| ▸ | PPARG | P37231 | 7/20 | 0.44 |
| ▸ | PPARD | Q03181 | 7/20 | 0.44 |
| ▸ | PPARA | Q07869 | 7/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.44 |
| ▸ | TSHR | P16473 | 4/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.44 |
| ▸ | TLR2 | O60603 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | FABP4 | P15090 | 2/20 | 0.44 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.44 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | PDE4A | P27815 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL27541545 | 0.98 | CES2 (0.50) | ALDH1A1CES2CES1GPR84PPARG | |
| Stearic Acid SCHEMBL28175504 | 0.90 | GPR84 (0.63) | ALDH1A1AKR1B1GPR84PPARGPPARD | |
| SCHEMBL27748575 | 0.87 | FAAH (0.62) | PPARGPPARDPPARAPTPN1TDP1 | |
| SCHEMBL7259935 | 0.86 | CES2 (0.52) | ALDH1A1CES2CES1AKR1B1GPR84 | |
| SCHEMBL3806653 | 0.84 | ALDH1A1 (0.46) | ALDH1A1CES2CES1AKR1B1GPR84 | |
| SCHEMBL10974021 | 0.84 | ALDH1A1 (0.46) | ALDH1A1CES2CES1AKR1B1GPR84 | |
| SCHEMBL18190858 | 0.83 | — | — | |
| SCHEMBL28846723 | 0.83 | FAAH (0.57) | PPARGPPARDPPARAPTPN1TDP1 | |
| SCHEMBL8462389 | 0.81 | CES2 (0.52) | ALDH1A1CES2CES1AKR1B1GPR84 | |
| SCHEMBL7400545 | 0.79 | KDM5A (0.56) | ALDH1A1AKR1B1GPR84PPARGPPARD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018013525-A1 | NUCLEIC ACID CONJUGATES AND USES THEREOF | TRANSLATE BIO MA, INC. (US) | 2018-01-18 | — | — | WO | disclosed |
| CN-101538222-B | Preparation method for N-(2-phenyl)ethyl-2-[(2,2-dimethoxyethyl)amino]acetamide halate | SHANGHAI INST PHARM INDUSTRY | 2012-12-26 | — | — | CN | disclosed |