Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 4/20 | 0.69 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.60 |
| ▸ | CTRC | Q99895 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | PTGES | O14684 | 1/20 | 0.48 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CASP7 | P55210 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | ALPL | P05186 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | DHODH | Q02127 | 2/20 | 0.47 |
| ▸ | RPA1 | P27694 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3408569 | 0.98 | KMO (0.71) | KMOMCL1CTRCALDH1A1HPGD | |
| Potassium SCHEMBL29961618 | 0.97 | KMO (0.69) | KMOMCL1CTRCALDH1A1HPGD | |
| SCHEMBL29062398 | 0.89 | KMO (0.68) | KMOMCL1ALDH1A1HPGDCA12 | |
| SCHEMBL21001267 | 0.85 | MCL1 (0.61) | KMOMCL1CTRCALDH1A1HPGD | |
| SCHEMBL34470953 | 0.83 | MCL1 (0.60) | KMOMCL1CTRCALDH1A1HPGD | |
| SCHEMBL29020161 | 0.83 | KMO (0.61) | KMOMCL1ALDH1A1KDM4EMAPT | |
| Potassium Ion SCHEMBL28802979 | 0.82 | KMO (0.51) | KMOMCL1CTRCALDH1A1HPGD | |
| SCHEMBL21001316 | 0.81 | KMO (0.67) | KMOMCL1CTRCALDH1A1HPGD | |
| SCHEMBL3408828 | 0.81 | KMO (0.62) | KMOMCL1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL29961681 | 0.80 | KMO (0.56) | KMOMCL1CTRCALDH1A1HPGD |
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-114835687-B | AhR inhibitors | 北京华森英诺生物科技有限公司 | 2023-09-05 | — | — | CN | disclosed |
| 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 |