Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.57 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.47 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | GRM5 | P41594 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALPL | P05186 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27871827 | 1.00 | ATM (0.57) | ATMCYP11B1CYP11B2ALDH1A1CYP2A6 | |
| SCHEMBL1439962 | 0.82 | ATM (0.65) | ATMCYP11B1CYP11B2ALDH1A1CYP2A6 | |
| SCHEMBL13326244 | 0.81 | ATM (0.62) | ATMCYP11B1CYP11B2ALDH1A1CYP2A6 | |
| SCHEMBL28135104 | 0.80 | CA1 (0.50) | ALDH1A1KDM4ECA12CA1CA2 | |
| SCHEMBL56951 | 0.80 | ATM (0.77) | ATMCYP11B1CYP11B2ALDH1A1CYP2A6 | |
| SCHEMBL10372910 | 0.78 | ATM (0.59) | ATMCYP11B1CYP11B2ALDH1A1CYP2A6 | |
| Hydrochloric Acid SCHEMBL2298745 | 0.78 | ATM (0.74) | ATMCYP11B1CYP11B2ALDH1A1CYP2A6 | |
| SCHEMBL10028683 | 0.77 | ATM (0.57) | ATMCYP11B1CYP11B2ALDH1A1CYP2A6 | |
| SCHEMBL4209337 | 0.77 | ATM (0.57) | ATMCYP11B1CYP11B2ALDH1A1CYP2A6 | |
| SCHEMBL14805797 | 0.77 | ATM (0.57) | ATMCYP11B1CYP11B2ALDH1A1CYP2A6 |
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-112480116-B | PKB inhibitors | 南京正大天晴制药有限公司 | 2024-03-29 | — | — | CN | disclosed |