Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.63 |
| ▸ | TSHR | P16473 | 4/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | APEX1 | P27695 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | NLRP3 | Q96P20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30186591 | 0.83 | NLRP3 (0.44) | ALDH1A1TSHRCYP3A4TP53POLB | |
| SCHEMBL5098181 | 0.78 | ALDH1A1 (1.00) | ALDH1A1TSHRCYP3A4CYP2D6CYP2C19 | |
| SCHEMBL5098171 | 0.78 | ALDH1A1 (1.00) | ALDH1A1TSHRCYP3A4CYP2D6CYP2C19 | |
| SCHEMBL15617 | 0.78 | ALDH1A1 (1.00) | ALDH1A1TSHRCYP3A4CYP2D6CYP2C19 | |
| SCHEMBL2048901 | 0.78 | ALDH1A1 (1.00) | ALDH1A1TSHRCYP3A4CYP2D6CYP2C19 | |
| Benzene SCHEMBL28134170 | 0.77 | ALDH1A1 (0.89) | ALDH1A1TSHRCYP3A4CYP2D6CYP2C19 | |
| Benzene SCHEMBL7777595 | 0.77 | ALDH1A1 (0.89) | ALDH1A1TSHRCYP3A4CYP2D6CYP2C19 | |
| SCHEMBL6684934 | 0.76 | ALDH1A1 (0.96) | ALDH1A1TSHRCYP3A4CYP2D6CYP2C19 | |
| Ethylene SCHEMBL7853286 | 0.76 | ALDH1A1 (0.96) | ALDH1A1TSHRCYP3A4CYP2D6CYP2C19 | |
| SCHEMBL20496120 | 0.76 | ALDH1A1 (0.96) | ALDH1A1TSHRCYP3A4CYP2D6CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-5057551-A | ADHESIVES THAT CONTINUE TO HARDEN IN DARKNESS AFTER PHOTOINITIATION | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 1991-10-15 | — | — | US | disclosed |