Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 2/20 | 0.48 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.48 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.46 |
| ▸ | AHR | P35869 | 2/20 | 0.42 |
| ▸ | GRIA1 | P42261 | 2/20 | 0.39 |
| ▸ | CACNG8 | Q8WXS5 | 2/20 | 0.39 |
| ▸ | SMYD3 | Q9H7B4 | 7/20 | 0.39 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28408499 | 0.81 | AHR (0.49) | CRBNAHRGRIA1CACNG8SMYD3 | |
| SCHEMBL18302957 | 0.78 | CRBN (0.39) | BRD4CREBBPCRBNAHRGRIA1 | |
| SCHEMBL25247020 | 0.76 | BRD4 (0.43) | BRD4CREBBPPAX8 | |
| SCHEMBL30476644 | 0.76 | BRD4 (0.43) | BRD4CREBBPPAX8 | |
| SCHEMBL26666452 | 0.76 | AHR (0.56) | AHRGRIA1CACNG8PDE3BPDE3A | |
| SCHEMBL29859998 | 0.76 | AHR (0.56) | AHRGRIA1CACNG8PDE3BPDE3A | |
| SCHEMBL8018111 | 0.73 | PAX8 (0.55) | BRD4CREBBPGAAPAX8 | |
| SCHEMBL20424754 | 0.73 | SMYD3 (0.50) | CRBNAHRGRIA1CACNG8SMYD3 | |
| SCHEMBL24191812 | 0.72 | MAOB (0.47) | CRBNPDE3BPDE3APDK2 | |
| SCHEMBL16285327 | 0.72 | PAX8 (0.40) | BRD4CREBBPGAAPAX8 |
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-111285872-B | Indole-2-ketone derivative and preparation method and application thereof | 北京志健金瑞生物医药科技有限公司 | 2022-05-17 | — | — | CN | disclosed |