Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.60 |
| ▸ | TSHR | P16473 | 3/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | PPARD | Q03181 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | BTN3A1 | O00481 | 1/20 | 0.32 |
| ▸ | LPAR3 | Q9UBY5 | 4/20 | 0.31 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.31 |
| ▸ | LPAR2 | Q9HBW0 | 2/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL27690368 | 0.90 | ALDH1A1 (0.48) | ALDH1A1TSHRTP53TDP1PPARD | |
| SCHEMBL8922109 | 0.89 | ALDH1A1 (0.75) | ALDH1A1TSHRCYP3A4TP53TDP1 | |
| Ethyl Chloride SCHEMBL11788111 | 0.85 | ALDH1A1 (0.52) | ALDH1A1TSHRCYP3A4TP53TDP1 | |
| SCHEMBL28435086 | 0.82 | ALDH1A1 (0.60) | ALDH1A1TSHRTP53BTN3A1LPAR3 | |
| SCHEMBL4906432 | 0.82 | ALDH1A1 (0.60) | ALDH1A1TSHRTP53BTN3A1LPAR3 | |
| Methyl Phosphonate SCHEMBL11440398 | 0.81 | ALDH1A1 (0.75) | ALDH1A1TSHRCYP3A4CA2LPAR3 | |
| SCHEMBL6738698 | 0.80 | ALDH1A1 (0.57) | ALDH1A1TSHRBTN3A1LPAR3LPAR1 | |
| Bromide SCHEMBL10486803 | 0.80 | ALDH1A1 (0.57) | ALDH1A1TSHRBTN3A1LPAR3LPAR1 | |
| Phosphoric Acid SCHEMBL6229840 | 0.80 | ALDH1A1 (0.83) | ALDH1A1TSHRCYP3A4LPAR3LPAR1 | |
| SCHEMBL28656454 | 0.79 | ALDH1A1 (0.54) | ALDH1A1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5476681-A | Hydrophobic agent protects foam from reacting with environmental moisture | BASF CORPORATION (US) | 1995-12-19 | — | — | US | disclosed |
| US-5405885-A | Reacting aromatic polyisocyanate with polyol composition including water as blowing agent in presence of lubricating oil to prevent foam from reacting with environmental water | BASF CORPORATION (US) | 1995-04-11 | — | — | US | disclosed |