Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | DPP4 | P27487 | 2/20 | 0.31 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9248110 | 0.71 | EPHX1 (0.45) | ALDH1A1EPHX1DPP4 | |
| SCHEMBL15711060 | 0.70 | CYP1A2 (0.31) | KDM4E | |
| SCHEMBL15710651 | 0.69 | HTR1A (0.33) | KDM4EALDH1A1SIGMAR1 | |
| SCHEMBL19293305 | 0.68 | KDM4E (0.48) | KDM4ETP53ALDH1A1CHRM3EPHX1 | |
| SCHEMBL30771313 | 0.68 | KDM4E (0.51) | KDM4ETP53ALDH1A1CHRM3EPHX1 | |
| SCHEMBL31724499 | 0.68 | TP53 (0.60) | KDM4ETP53ALDH1A1CHRM3LMNA | |
| SCHEMBL2437542 | 0.67 | KDM4E (0.41) | KDM4ETP53ALDH1A1CHRM3EPHX1 | |
| SCHEMBL2429692 | 0.67 | KDM4E (0.41) | KDM4ETP53ALDH1A1CHRM3EPHX1 | |
| SCHEMBL20938908 | 0.64 | KDM4E (0.46) | KDM4ETP53ALDH1A1CHRM3LMNA | |
| SCHEMBL19631132 | 0.64 | KDM4E (0.42) | KDM4ETP53ALDH1A1CHRM3LMNA |
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-109641908-A | Five-ring heterocycles simultaneously [3,4-d] pyridazinone compound, preparation method, pharmaceutical composition and its application | 中国科学院上海药物研究所 | 2019-04-16 | — | — | CN | disclosed |