Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.64 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | DAO | P14920 | 1/20 | 0.52 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.52 |
| ▸ | SRD5A2 | P31213 | 5/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.50 |
| ▸ | CES1 | P23141 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.45 |
| ▸ | KIF11 | P52732 | 1/20 | 0.45 |
| ▸ | RXRA | P19793 | 1/20 | 0.43 |
| ▸ | RXRB | P28702 | 1/20 | 0.43 |
| ▸ | RARB | P10826 | 1/20 | 0.43 |
| ▸ | RARG | P13631 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL15367600 | 0.94 | CYP2C9 (0.59) | CYP2C9TSHRDAONAPRTSRD5A2 | |
| Benzylic Acid SCHEMBL7066 | 0.87 | CYP2C9 (0.74) | CYP2C9TSHRCYP2D6HIF1ACYP1A2 | |
| Benzylic Acid SCHEMBL5705762 | 0.84 | CYP2C9 (0.71) | CYP2C9TSHRCYP2D6HIF1ACYP1A2 | |
| Benzylic Acid SCHEMBL9181980 | 0.84 | CYP2C9 (0.71) | CYP2C9TSHRCYP2D6HIF1ACYP1A2 | |
| Benzylic Acid SCHEMBL2810363 | 0.84 | CYP2C9 (0.71) | CYP2C9TSHRCYP2D6HIF1ACYP1A2 | |
| Benzylic Acid SCHEMBL1680669 | 0.84 | CYP2C9 (0.71) | CYP2C9TSHRCYP2D6HIF1ACYP1A2 | |
| Benzylic Acid SCHEMBL11049826 | 0.84 | CYP2C9 (0.71) | CYP2C9TSHRCYP2D6HIF1ACYP1A2 | |
| Benzylic Acid SCHEMBL9568239 | 0.84 | CYP2C9 (0.71) | CYP2C9TSHRCYP2D6HIF1ACYP1A2 | |
| Benzylic Acid SCHEMBL20957595 | 0.84 | CYP2C9 (0.71) | CYP2C9TSHRCYP2D6HIF1ACYP1A2 | |
| Benzylic Acid SCHEMBL1681667 | 0.84 | CYP2C9 (0.71) | CYP2C9TSHRCYP2D6HIF1ACYP1A2 |
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-103221341-B | Surface-modified silica powder and method for producing the same, as well as toner composition for electrophotography | NIPPON AEROSIL CO LTD | 2015-06-10 | — | — | CN | disclosed |