Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 6/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | MAOA | P21397 | 2/20 | 0.49 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.49 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.44 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | IL4I1 | Q96RQ9 | 1/20 | 0.43 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.42 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1299218 | 1.00 | MAOB (0.53) | MAOBCA2MAOAPTPN1CYP11B1 | |
| SCHEMBL29277424 | 0.87 | MAOB (0.67) | MAOBCA2MAOAPTPN1CYP11B1 | |
| SCHEMBL6590449 | 0.81 | MAOB (0.50) | MAOBCA2MAOAPTPN1CYP11B1 | |
| SCHEMBL13134181 | 0.81 | MAOB (0.49) | MAOBCA2MAOAPTPN1CYP11B1 | |
| SCHEMBL9114091 | 0.78 | MAOB (0.46) | MAOBCA2MAOAPTPN1CYP11B1 | |
| SCHEMBL6511944 | 0.78 | MAOB (0.63) | MAOBCA2MAOAPTPN1CYP11B1 | |
| SCHEMBL1252407 | 0.78 | CA2 (0.59) | MAOBCA2MAOAPTPN1CYP11B1 | |
| SCHEMBL24106036 | 0.77 | CA2 (0.58) | MAOBCA2MAOAPTPN1PSMB8 | |
| SCHEMBL28105832 | 0.77 | MAOB (0.49) | MAOBCA2MAOAPTPN1CYP11B1 | |
| SCHEMBL27776938 | 0.76 | CA2 (0.57) | MAOBCA2MAOAPTPN1CYP11B1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117069720-A | 5-HT 2A Receptor agonist, preparation method and application thereof | 上海翊石医药科技有限公司 | 2023-11-17 | — | — | CN | disclosed |
| CN-117003776-A | Boric acid proteasome inhibitor and application thereof | 科辉智药生物科技(深圳)有限公司 | 2023-11-07 | — | — | CN | disclosed |