Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HMGCR | P04035 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL28528220 | 0.87 | TSHR (0.56) | CYP3A4TSHRALDH1A1CA2CA9 | |
| SCHEMBL11207515 | 0.83 | CYP3A4 (0.48) | CYP3A4TSHRALDH1A1MEN1KMT2A | |
| SCHEMBL11312474 | 0.83 | CYP3A4 (0.48) | CYP3A4TSHRALDH1A1MEN1KMT2A | |
| SCHEMBL104844 | 0.81 | CYP3A4 (0.68) | CYP3A4TSHRALDH1A1MEN1KMT2A | |
| SCHEMBL17327650 | 0.80 | CA2 (0.35) | CYP3A4TSHRALDH1A1CA2CA9 | |
| SCHEMBL17943797 | 0.78 | CYP3A4 (0.48) | CYP3A4TSHRALDH1A1MEN1KMT2A | |
| SCHEMBL15977286 | 0.78 | ALDH1A1 (0.36) | CYP3A4ALDH1A1CA2CA9 | |
| SCHEMBL31023525 | 0.78 | CYP3A4 (0.65) | CYP3A4TSHRALDH1A1MEN1KMT2A | |
| Ammonia Solution, Strong SCHEMBL11326091 | 0.78 | CYP3A4 (0.65) | CYP3A4TSHRALDH1A1MEN1KMT2A | |
| Methane SCHEMBL28409090 | 0.78 | CYP3A4 (0.65) | CYP3A4TSHRALDH1A1MEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109942622-B | Preparation method of unsaturated hydrocarbon-containing phosphate ester flame retardant | 张家港市国泰华荣化工新材料有限公司 | 2021-10-15 | — | — | CN | disclosed |