Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 1/20 | 0.44 |
| ▸ | RPS6KA3 | P51812 | 5/20 | 0.44 |
| ▸ | NUDT1 | P36639 | 2/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | LATS1 | O95835 | 5/20 | 0.40 |
| ▸ | LATS2 | Q9NRM7 | 3/20 | 0.40 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.38 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL23071609 | 0.98 | DHODH (0.43) | DHODHRPS6KA3NUDT1CYP11B1LATS1 | |
| SCHEMBL13951322 | 0.79 | NUDT1 (0.41) | DHODHNUDT1CYP11B1LATS1LATS2 | |
| SCHEMBL2405729 | 0.79 | NUDT1 (0.41) | DHODHNUDT1CYP11B1LATS1LATS2 | |
| SCHEMBL1659140 | 0.78 | CYP11B1 (0.56) | DHODHCYP11B1KDM1A | |
| SCHEMBL10067577 | 0.76 | RPS6KA3 (0.68) | RPS6KA3NUDT1CYP11B1 | |
| SCHEMBL23319259 | 0.75 | KMO (0.46) | DHODHCYP11B1KDM1AGABRG2GABRB3 | |
| SCHEMBL16897023 | 0.75 | RPS6KA3 (0.46) | DHODHRPS6KA3NUDT1CYP11B1LATS1 | |
| SCHEMBL16897143 | 0.74 | CYP2A6 (0.48) | NUDT1GABRA1GABRG2GABRB3GABRA5 | |
| Hydrochloric Acid SCHEMBL16897863 | 0.74 | RPS6KA3 (0.66) | RPS6KA3NUDT1CYP11B1 | |
| SCHEMBL31301232 | 0.73 | NUDT1 (0.57) | RPS6KA3NUDT1LATS1LATS2MKNK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102731492-A | Cyclohexane derivative, its preparation method and its application in medicines | JIANGSU HENGRUI MEDICINE CO | 2012-10-17 | — | — | CN | disclosed |
| CN-102432598-A | Tricyclic compound, preparation method thereof and pharmaceutical application thereof | JIANGSU HENGRUI MEDICINE CO | 2012-05-02 | — | — | CN | disclosed |
| WO-2012041158-A1 | TRICYCLIC COMPOUND, PREPARATION METHOD AND PHARMACEUTICAL USE THEREOF | 上海恒瑞医药有限公司 (CN) | 2012-04-05 | — | — | WO | disclosed |