Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.43 |
| ▸ | PSMB8 | P28062 | 4/20 | 0.42 |
| ▸ | PSMB5 | P28074 | 4/20 | 0.42 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | EP300 | Q09472 | 1/20 | 0.37 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30148867 | 0.87 | KDM4C (0.55) | KDM4CPSMB8PSMB5MAOBSIGMAR1 | |
| SCHEMBL5107704 | 0.77 | KDM4C (0.43) | KDM4CEP300CREBBPMEN1KMT2A | |
| SCHEMBL15635161 | 0.76 | KDM4C (0.43) | KDM4CEP300CREBBPCA2MEN1 | |
| SCHEMBL14476044 | 0.76 | KDM4C (0.43) | KDM4CEP300CREBBPMEN1KMT2A | |
| SCHEMBL18355699 | 0.76 | TACR1 (0.46) | KDM4CEP300CREBBPSIGMAR1MEN1 | |
| SCHEMBL93028 | 0.75 | CYP2A6 (0.43) | KDM4CEP300CREBBPCA2KMT2A | |
| SCHEMBL2006340 | 0.74 | TACR1 (0.45) | KDM4CEP300CREBBPMEN1KMT2A | |
| SCHEMBL13490826 | 0.74 | KDM4C (0.43) | KDM4CEP300CREBBPMEN1KMT2A | |
| SCHEMBL13787407 | 0.74 | KDM4C (0.43) | KDM4CEP300CREBBPCA2MEN1 | |
| SCHEMBL8264206 | 0.74 | KDM4C (0.43) | KDM4CEP300CREBBPMEN1KMT2A |
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-115521325-A | Boronic acid derivatives | 首药控股(北京)股份有限公司 | 2022-12-27 | — | — | CN | disclosed |