Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 1/20 | 0.55 |
| ▸ | KMO | O15229 | 4/20 | 0.54 |
| ▸ | CTRC | Q99895 | 3/20 | 0.54 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | DHODH | Q02127 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | PTGES | O14684 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL21001267 | 0.92 | MCL1 (0.61) | MCL1KMOCTRCADORA3KDM4E | |
| SCHEMBL28803081 | 0.83 | CTRC (0.55) | MCL1KMOCTRCMAPTMEN1 | |
| SCHEMBL29808904 | 0.83 | CTRC (0.55) | MCL1KMOCTRCMAPTMEN1 | |
| SCHEMBL29961689 | 0.82 | KMO (0.51) | MCL1KMOCTRCADORA3KDM4E | |
| SCHEMBL29020124 | 0.82 | KMO (0.51) | MCL1KMOCTRCADORA3KDM4E | |
| SCHEMBL29020201 | 0.82 | KMO (0.51) | MCL1KMOCTRCADORA3KDM4E | |
| SCHEMBL29020194 | 0.82 | KDM4E (0.62) | MCL1KMOCTRCADORA3MAPT | |
| SCHEMBL29961510 | 0.82 | MCL1 (0.51) | MCL1KMOCTRCADORA3MAPT | |
| SCHEMBL29962056 | 0.82 | KDM4E (0.62) | MCL1KMOCTRCADORA3MAPT | |
| SCHEMBL29020139 | 0.81 | KMO (0.56) | MCL1KMOCTRCADORA3KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115093400-B | AhR inhibitor, application and preparation method thereof | 北京华森英诺生物科技有限公司 | 2023-09-05 | — | — | CN | disclosed |
| CN-115093400-A | AhR inhibitor and application and preparation method thereof | 重庆华森制药股份有限公司 | 2022-09-23 | — | — | CN | disclosed |