Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1498184 | 0.86 | CYP2D6 (0.35) | ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL52705 | 0.86 | CYP2D6 (0.35) | ALDH1A1CYP2D6CYP2C19 | |
| Styrene SCHEMBL28305876 | 0.84 | ALDH1A1 (0.34) | ALDH1A1TSHRCYP2D6CYP2C19 | |
| Hydrochloric Acid SCHEMBL16599964 | 0.84 | CYP2D6 (0.34) | CYP2D6CYP2C19 | |
| Hydrochloric Acid SCHEMBL16599969 | 0.84 | CYP2D6 (0.34) | CYP2D6CYP2C19 | |
| Methacrylic Acid SCHEMBL28236077 | 0.83 | CYP2D6 (0.36) | ALDH1A1TSHRCYP2D6CYP2C19 | |
| SCHEMBL28854013 | 0.81 | TDP1 (0.41) | TSHRTDP1CYP2D6CYP2C19 | |
| Benzene SCHEMBL28209984 | 0.80 | GRIK1 (0.33) | ALDH1A1TSHRCYP2D6CYP2C19 | |
| Phosphoric Acid SCHEMBL15156947 | 0.79 | CYP2D6 (0.32) | CYP2D6CYP2C19 | |
| Acrylamide SCHEMBL28086872 | 0.78 | TSHR (0.38) | ALDH1A1TSHRCYP2D6CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105308131-B | Aqueous coating composition | 陶氏环球技术有限责任公司 | 2018-04-13 | — | — | CN | disclosed |
| CN-105612222-A | Aqueous coating composition and method for producing same | DOW GLOBAL TECHNOLOGIES INC | 2016-05-25 | — | — | CN | disclosed |