Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA4 | P22748 | 1/20 | 0.50 |
| ▸ | CA7 | P43166 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | APP | P05067 | 1/20 | 0.43 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9115698 | 0.78 | CA1 (0.56) | CA1CA2CA12CA4CA7 | |
| SCHEMBL5830923 | 0.77 | CA12 (0.62) | CA1CA2CA12CA4CA7 | |
| 1-Allyloxy-2-Methoxybenzene SCHEMBL30083991 | 0.76 | CA12 (0.54) | CA1CA2CA12CA4CA7 | |
| 1-Allyloxy-2-Methoxybenzene SCHEMBL73345 | 0.76 | CA12 (0.54) | CA1CA2CA12CA4CA7 | |
| SCHEMBL514581 | 0.76 | CA1 (0.54) | CA1CA2CA12CA4CA7 | |
| Ammonia Solution, Strong SCHEMBL27917945 | 0.75 | CA12 (0.59) | CA1CA2CA12CA4CA7 | |
| SCHEMBL1907827 | 0.74 | CA1 (0.52) | CA1CA2CA12CA4CA7 | |
| 1,2-Dimethoxybenzene SCHEMBL10436213 | 0.74 | CA1 (0.72) | CA1CA2CA12CA4CA7 | |
| SCHEMBL401448 | 0.74 | KDM4E (0.75) | CA1CA2CA12CA4CA7 | |
| SCHEMBL10901672 | 0.73 | CA1 (0.50) | CA1CA2CA12CA4CA7 |
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-102875490-A | Synthetic method used for preparing ranolazine | UNIV SICHUAN | 2013-01-16 | — | — | CN | disclosed |