Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.34 |
| ▸ | PGD | P52209 | 2/20 | 0.33 |
| ▸ | OR51E2 | Q9H255 | 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 | |
|---|---|---|---|---|
| SCHEMBL514701 | 0.80 | TSHR (0.41) | TSHRCYP2C9PDE4APGD | |
| SCHEMBL4247426 | 0.75 | MMP1 (0.38) | TSHRCYP2C9PDE4APGD | |
| SCHEMBL234927 | 0.74 | TSHR (0.39) | TSHRCYP2C9PDE4APGDOR51E2 | |
| SCHEMBL23630284 | 0.74 | TSHR (0.41) | TSHRCYP2C9PDE4APGDOR51E2 | |
| SCHEMBL28092726 | 0.73 | PGD (0.36) | TSHRPGDOR51E2 | |
| Propylene Glycol SCHEMBL3729380 | 0.72 | TDP1 (0.39) | TSHRCYP2C9PDE4APGDOR51E2 | |
| SCHEMBL2963336 | 0.71 | TSHR (0.41) | TSHRCYP2C9PDE4APGD | |
| SCHEMBL4214657 | 0.71 | PDE4A (0.39) | TSHRCYP2C9PDE4APGDOR51E2 | |
| Ethylene Glycol SCHEMBL3738613 | 0.71 | PGD (0.37) | TSHRCYP2C9PDE4APGDOR51E2 | |
| SCHEMBL3463165 | 0.71 | TSHR (0.36) | TSHRCYP2C9PDE4APGDOR51E2 |
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-5705089-A | HYDROGEN PEROXIDE, PHOSPHONIC ACID CHELATEING AGENT, WETTING AGENT | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 1998-01-06 | — | — | US | claimed |