Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | APAF1 | O14727 | 1/20 | 0.38 |
| ▸ | RAD52 | P43351 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10383611 | 1.00 | IDO1 (0.47) | IDO1TSHRALDH1A1LMNANR5A1 | |
| SCHEMBL14948690 | 0.93 | IDO1 (0.50) | IDO1TSHRALDH1A1HTTHPGD | |
| SCHEMBL18171753 | 0.89 | IDO1 (0.57) | IDO1TSHRALDH1A1HTTHPGD | |
| SCHEMBL7222677 | 0.85 | IDO1 (0.53) | IDO1TSHRALDH1A1LMNAHTT | |
| SCHEMBL18171754 | 0.85 | IDO1 (0.57) | IDO1TSHRALDH1A1HTTHPGD | |
| SCHEMBL31163835 | 0.83 | IDO1 (0.47) | IDO1ALDH1A1HTTHPGDCHRM3 | |
| Alcohol SCHEMBL23234322 | 0.81 | IDO1 (0.46) | IDO1TSHRALDH1A1HTTHPGD | |
| SCHEMBL18171748 | 0.81 | IDO1 (0.61) | IDO1TSHRALDH1A1HTTCHRM3 | |
| SCHEMBL7178486 | 0.81 | LTA4H (0.40) | TSHRALDH1A1LMNANR5A1LIPG | |
| SCHEMBL1840225 | 0.79 | NR5A1 (0.47) | IDO1TSHRALDH1A1LMNANR5A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108738321-A | GalNAc cluster phosphoramidites | 豪夫迈·罗氏有限公司 | 2018-11-02 | — | — | CN | disclosed |
| WO-1995019336-A1 | PHENYL ETHANOL AMINE ETHERS AND USES THEREOF AS β-ADRENO-RECEPTOR AGONISTS | IOVIS BIOMEDICAL AND PHARMACEUTICAL CONSULTANTS (NL) | 1995-07-20 | — | — | WO | disclosed |
| CN-1037342-A | Phosphonoalkylpurinederivatives derivatives | MERRELL DOW PHARMA (US) | 1989-11-22 | — | — | CN | disclosed |