Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 2/20 | 0.33 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.31 |
| ▸ | BAZ2A | Q9UIF9 | 1/20 | 0.31 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.30 |
| ▸ | SUV39H2 | Q9H5I1 | 4/20 | 0.30 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.30 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.30 |
| ▸ | RAF1 | P04049 | 1/20 | 0.30 |
| ▸ | BRAF | P15056 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | RECQL | P46063 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20158039 | 0.92 | BRD4 (0.34) | BRD4SUV39H2HDAC10HDAC6 | |
| SCHEMBL21550125 | 0.88 | ALDH1A1 (0.36) | BRD4BAZ2BBAZ2AHDAC10HDAC6 | |
| SCHEMBL21550252 | 0.88 | ALDH1A1 (0.34) | BRD4HDAC10HDAC6 | |
| SCHEMBL20157852 | 0.88 | BRD4 (0.36) | BRD4HDAC10HDAC6 | |
| SCHEMBL21564924 | 0.87 | HDAC10 (0.36) | BRD4BAZ2BBAZ2AHDAC10HDAC6 | |
| SCHEMBL21550141 | 0.86 | PKM (0.36) | BAZ2BBAZ2AHDAC10HDAC6 | |
| SCHEMBL21550059 | 0.85 | NAMPT (0.33) | BRD4HDAC10HDAC6 | |
| SCHEMBL21550010 | 0.84 | BRD4 (0.36) | BRD4HDAC10HDAC6RAF1BRAF | |
| SCHEMBL20157351 | 0.84 | HDAC10 (0.36) | BRD4HDAC10HDAC6SMN1; SMN2 | |
| SCHEMBL20157909 | 0.84 | BRD4 (0.34) | BRD4HDAC10HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3539960-A1 | NITROGENOUS MACROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF | Luoxin Pharmaceutical (Shanghai) Co., Ltd. (CN) | 2019-09-18 | — | — | EP | disclosed |