Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.52 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | PRKACA | P17612 | 1/20 | 0.42 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.42 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL21158507 | 0.96 | ESR1 (0.54) | ESR1ESR2HDAC1HDAC8HDAC6 | |
| SCHEMBL19369873 | 0.96 | ESR1 (0.54) | ESR1ESR2HDAC1HDAC8HDAC6 | |
| SCHEMBL25921221 | 0.96 | ESR1 (0.53) | ESR1ESR2HDAC1HDAC8HDAC6 | |
| SCHEMBL24353069 | 0.96 | ESR1 (0.56) | ESR1ESR2HDAC1HDAC8HDAC6 | |
| SCHEMBL21158039 | 0.95 | ESR1 (0.56) | ESR1ESR2HDAC1HDAC8HDAC6 | |
| SCHEMBL21158000 | 0.95 | ESR1 (0.56) | ESR1ESR2HDAC1HDAC8HDAC6 | |
| SCHEMBL21158506 | 0.95 | ESR1 (0.56) | ESR1ESR2HDAC1HDAC8HDAC6 | |
| SCHEMBL19369870 | 0.95 | ESR1 (0.56) | ESR1ESR2HDAC1HDAC8HDAC6 | |
| SCHEMBL22308608 | 0.93 | ESR1 (0.53) | ESR1ESR2HDAC1HDAC8HDAC6 | |
| SCHEMBL22308609 | 0.93 | ESR1 (0.53) | ESR1ESR2HDAC1HDAC8HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023142486-A1 | BORON-NITROGEN COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF | 季华恒烨(佛山)电子材料有限公司 | 2023-08-03 | — | — | WO | disclosed |
| WO-2023142485-A1 | BORON-NITROGEN COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF | 季华恒烨(佛山)电子材料有限公司 | 2023-08-03 | — | — | WO | disclosed |