Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 8/20 | 0.45 |
| ▸ | MAPT | P10636 | 8/20 | 0.45 |
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | CNR2 | P34972 | 2/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL24152329 | 0.84 | GSK3B (0.50) | SMN1; SMN2ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL24938858 | 0.83 | ALDH1A1 (0.45) | SMN1; SMN2ALDH1A1KDM4EL3MBTL1TSHR | |
| SCHEMBL24939938 | 0.83 | P2RX4 (0.38) | KDM4EHPGDCYP19A1L3MBTL1HTT | |
| SCHEMBL28980928 | 0.80 | DRD2 (0.43) | FAAHALDH1A1LMNAKDM4EL3MBTL1 | |
| SCHEMBL24939886 | 0.78 | HTR6 (0.45) | MAPTCNR2CYP19A1 | |
| SCHEMBL30336973 | 0.78 | KMT2A (0.49) | FAAH | |
| SCHEMBL24939995 | 0.76 | HDAC3 (0.42) | ALDH1A1CYP19A1CYP2C19 | |
| SCHEMBL24938979 | 0.74 | CACNB4 (0.43) | CYP19A1 | |
| SCHEMBL24939957 | 0.74 | F10 (0.41) | MAPTALDH1A1KDM4EHTTNPSR1 | |
| SCHEMBL28980935 | 0.74 | KDM4E (0.47) | MAPTSMN1; SMN2ALDH1A1KDM4EHPGD |
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-115916206-A | Novel compound and pharmaceutical composition for preventing or treating resistant cancer comprising same | 治愈医药社株式会社 | 2023-04-04 | — | — | CN | disclosed |