Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 2/20 | 0.62 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.51 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.50 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.49 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.49 |
| ▸ | HTR3B | O95264 | 1/20 | 0.49 |
| ▸ | HTR5A | P47898 | 1/20 | 0.49 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.49 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | DPP4 | P27487 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL22728551 | 0.85 | HTR3A (0.66) | HTR3ASIGMAR1HTR3EHTR3BHTR5A | |
| SCHEMBL29732325 | 0.83 | HRH3 (0.50) | HTR3ACHRNA7KCNH2CHRNB2CHRNA4 | |
| SCHEMBL22721137 | 0.83 | HRH3 (0.50) | HTR3ACHRNA7KCNH2CHRNB2CHRNA4 | |
| SCHEMBL29732518 | 0.82 | HTR3A (0.49) | HTR3ACHRNA7KCNH2SIGMAR1HTR3E | |
| SCHEMBL22721152 | 0.82 | HTR3A (0.49) | HTR3ACHRNA7KCNH2SIGMAR1HTR3E | |
| SCHEMBL22728598 | 0.80 | HTR3A (0.46) | HTR3ACHRNA7KCNH2SIGMAR1HTR3E | |
| SCHEMBL22721059 | 0.79 | BPTF (0.62) | HTR3ACHRNA7CHRNB2CHRNA4SIGMAR1 | |
| SCHEMBL928578 | 0.79 | CHRNA7 (0.72) | HTR3ACHRNA7KCNH2CHRNB2CHRNA4 | |
| Oxalic Acid SCHEMBL22721005 | 0.78 | HTR3A (0.56) | HTR3ASIGMAR1HTR3EHTR3BHTR5A | |
| SCHEMBL22728500 | 0.77 | HTR3A (0.63) | HTR3AKCNH2SIGMAR1HTR3EHTR3B |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118359619-A | Salt of antidepressant compound, preparation method thereof, pharmaceutical composition containing salt and application of salt | 苏州旺山旺水生物医药股份有限公司 | 2024-07-19 | — | — | CN | disclosed |
| CN-112010859-B | Fused ring compound, preparation method and application thereof | 中国科学院上海药物研究所 | 2022-07-19 | — | — | CN | disclosed |
| WO-2020239073-A1 | FUSED RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF | 中国科学院上海药物研究所 | 2020-12-03 | — | — | WO | disclosed |
| WO-2020239073-A1 | FUSED RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF | 中国科学院上海药物研究所 | 2020-12-03 | — | — | WO | disclosed |