Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 5/20 | 0.70 |
| ▸ | CA1 | P00915 | 4/20 | 0.70 |
| ▸ | CA12 | O43570 | 3/20 | 0.70 |
| ▸ | CA7 | P43166 | 3/20 | 0.70 |
| ▸ | CA9 | Q16790 | 3/20 | 0.70 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.70 |
| ▸ | CA3 | P07451 | 1/20 | 0.70 |
| ▸ | TYR | P14679 | 1/20 | 0.70 |
| ▸ | DRD1 | P21728 | 1/20 | 0.70 |
| ▸ | CA4 | P22748 | 1/20 | 0.70 |
| ▸ | CA6 | P23280 | 1/20 | 0.70 |
| ▸ | CA5A | P35218 | 1/20 | 0.70 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.70 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.61 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | CPT1B | Q92523 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Hydroquinone SCHEMBL29193635 | 0.86 | CA12 (0.61) | CA2CA1CA12CA7CA9 | |
| Methylparaben SCHEMBL2357971 | 0.85 | CA1 (0.83) | CA2CA1CA12CA7CA9 | |
| Paraben SCHEMBL2648402 | 0.84 | CA2 (0.80) | CA2CA1CA12CA7CA9 | |
| Paraben SCHEMBL1685428 | 0.84 | CA2 (0.89) | CA2CA1CA12CA7CA9 | |
| Paraben SCHEMBL27392236 | 0.84 | CA2 (0.89) | CA2CA1CA12CA7CA9 | |
| Paraben SCHEMBL5311518 | 0.83 | CA2 (1.00) | CA2CA1CA12CA7CA9 | |
| Terephthalic Acid SCHEMBL6692916 | 0.83 | CA2 (1.00) | CA2CA1CA12CA7CA9 | |
| Paraben SCHEMBL20500516 | 0.83 | CA2 (1.00) | CA2CA1CA12CA7CA9 | |
| Terephthalic Acid SCHEMBL3460105 | 0.83 | CA2 (1.00) | CA2CA1CA12CA7CA9 | |
| Paraben SCHEMBL7622776 | 0.83 | CA2 (1.00) | CA2CA1CA12CA7CA9 |
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-106365979-A | Method for synthesizing p-methoxybenzoic acid | 贝利化学（张家港）有限公司 | 2017-02-01 | — | — | CN | disclosed |