Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.45 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | AR | P10275 | 3/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.43 |
| ▸ | ESRRA | P11474 | 2/20 | 0.43 |
| ▸ | MAOB | P27338 | 3/20 | 0.43 |
| ▸ | MAOA | P21397 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL25285812 | 1.00 | CYP19A1 (0.50) | CYP19A1ALDH1A1HPGDPARP10PARP3 | |
| SCHEMBL8551880 | 0.87 | AR (0.53) | CYP19A1ALDH1A1PARP10PARP3AR | |
| SCHEMBL30185052 | 0.85 | CYP19A1 (0.54) | CYP19A1ALDH1A1HPGDNPSR1AR | |
| SCHEMBL28686276 | 0.85 | CYP19A1 (0.54) | CYP19A1ALDH1A1HPGDNPSR1AR | |
| SCHEMBL20934585 | 0.85 | PARP10 (0.45) | CYP19A1ALDH1A1HPGDPARP10PARP3 | |
| SCHEMBL4809997 | 0.85 | SLC22A12 (0.47) | ALDH1A1PARP10PARP3ARESRRA | |
| SCHEMBL3696845 | 0.85 | AR (0.51) | ALDH1A1PARP10PARP3ARESRRA | |
| SCHEMBL1377229 | 0.85 | CYP19A1 (0.62) | CYP19A1ALDH1A1HPGDNPSR1AR | |
| SCHEMBL9472016 | 0.85 | CYP19A1 (0.62) | CYP19A1ALDH1A1HPGDNPSR1AR | |
| SCHEMBL4581525 | 0.83 | CYP19A1 (0.65) | CYP19A1ALDH1A1HPGDNPSR1AR |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117820377-A | Cyclotriphosphazene derivative flame retardant containing phthalonitrile structure and preparation method and application thereof | 中国科学院宁波材料技术与工程研究所 | 2024-04-05 | — | — | CN | disclosed |
| CN-115368276-B | Novel bisphthalonitrile compound and application thereof | 北京化工大学 | 2024-02-02 | — | — | CN | disclosed |
| CN-115368563-B | Solvent-free method for preparing aldimine bond-containing bisphthalonitrile compound, polymer and application thereof | 北京化工大学 | 2023-12-15 | — | — | CN | disclosed |
| CN-116332982-A | Liquid processable diphthalic nitrile monomers and resins | 劳斯莱斯有限公司 | 2023-06-27 | — | — | CN | disclosed |
| CN-113817166-B | Acid-base co-fusion based imidazole dinitrile resin and preparation method thereof | 四川大学 | 2023-01-17 | — | — | CN | disclosed |
| CN-115368563-A | Solvent-free method for preparing bis-phthalonitrile compound containing aldimine bond, polymer and application thereof | 北京化工大学 | 2022-11-22 | — | — | CN | disclosed |
| CN-115368276-A | Novel bisphthalonitrile compound and application thereof | 北京化工大学 | 2022-11-22 | — | — | CN | disclosed |