Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNC | P24863 | 1/20 | 0.47 |
| ▸ | CDK8 | P49336 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | MAP2K1 | Q02750 | 9/20 | 0.38 |
| ▸ | MAP2K2 | P36507 | 8/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | BRD4 | O60885 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15991636 | 0.82 | CCNC (0.49) | CCNCCDK8PKMKDM4EBRD4 | |
| SCHEMBL29812644 | 0.81 | MAP2K1 (0.41) | MAP2K1MAP2K2KDM4EBRD4ALDH1A1 | |
| SCHEMBL23772011 | 0.78 | L3MBTL1 (0.39) | MAP2K1MAP2K2KDM4EBRD4BRD9 | |
| SCHEMBL29868687 | 0.77 | MAP2K1 (0.41) | MAP2K1MAP2K2KDM4E | |
| SCHEMBL28838264 | 0.77 | ADRA1D (0.36) | CCNCCDK8 | |
| SCHEMBL19151400 | 0.74 | CCNC (0.51) | CCNCCDK8PKMMAP2K1MAP2K2 | |
| SCHEMBL13527129 | 0.74 | CCNC (0.51) | CCNCCDK8PKMKDM4EBRD4 | |
| SCHEMBL10002537 | 0.74 | CDK8 (0.51) | CCNCCDK8PKMMAP2K1MAP2K2 | |
| Hydrochloric Acid SCHEMBL17781591 | 0.72 | CCNC (0.50) | CCNCCDK8PKMKDM4EBRD4 | |
| SCHEMBL28811450 | 0.72 | CCNC (0.50) | CCNCCDK8PKMKDM4EBRD4 |
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-110627796-B | Nitrogenous heterocyclic derivative and application thereof in medicine | 北京越之康泰生物医药科技有限公司 | 2022-07-12 | — | — | CN | disclosed |
| CN-110627796-A | Nitrogenous heterocyclic derivative and application thereof in medicine | 北京越之康泰生物医药科技有限公司 | 2019-12-31 | — | — | CN | disclosed |
| CN-110520416-A | Polysubstituted pyridine ketones derivant, preparation method and its medical usage | BEIJING YUEZHIKANGTAI BIOMEDICINES CO LTD | 2019-11-29 | — | — | CN | disclosed |