Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 3/20 | 0.47 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.47 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.47 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.47 |
| ▸ | ACACB | O00763 | 7/20 | 0.45 |
| ▸ | OGA | O60502 | 1/20 | 0.43 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.42 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.42 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.41 |
| ▸ | LCAT | P04180 | 1/20 | 0.40 |
| ▸ | F10 | P00742 | 1/20 | 0.40 |
| ▸ | MLLT1 | Q03111 | 1/20 | 0.40 |
| ▸ | OXTR | P30559 | 1/20 | 0.40 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.40 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30574420 | 0.87 | CHRNB2 (0.50) | CHRNB2CHRNA4CHRNB4CHRNA3ACACB | |
| SCHEMBL21384592 | 0.87 | CHRNB2 (0.50) | CHRNB2CHRNA4CHRNB4CHRNA3ACACB | |
| SCHEMBL4389854 | 0.83 | MAPT (0.57) | CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL21384573 | 0.82 | ALDH1A1 (0.54) | ACACB | |
| SCHEMBL16648701 | 0.78 | MAPT (0.54) | ACACB | |
| Hydrochloric Acid SCHEMBL21384628 | 0.78 | CHRNB2 (0.53) | CHRNB2CHRNA4CHRNB4CHRNA3ACACB | |
| Hydrochloric Acid SCHEMBL30574425 | 0.78 | CHRNB2 (0.53) | CHRNB2CHRNA4CHRNB4CHRNA3ACACB | |
| SCHEMBL21385141 | 0.77 | MAPT (0.45) | — | |
| SCHEMBL1441410 | 0.76 | CHRNB2 (0.54) | CHRNB2CHRNA4CHRNB4CHRNA3LCAT | |
| SCHEMBL16769739 | 0.76 | CHRNB2 (0.54) | CHRNB2CHRNA4CHRNB4CHRNA3ACACB |
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-117185987-A | Amidine and guanidine derivatives, preparation method and medical application thereof | 四川科伦博泰生物医药股份有限公司 | 2023-12-08 | — | — | CN | disclosed |
| CN-111630048-B | Amidine and guanidine derivatives, preparation method and medical application thereof | 四川科伦博泰生物医药股份有限公司 | 2023-09-29 | — | — | CN | disclosed |
| CN-111630048-A | Amidine and guanidine derivatives, preparation method and application thereof in medicines | 四川科伦博泰生物医药股份有限公司 | 2020-09-04 | — | — | CN | disclosed |
| WO-2019179362-A1 | AMIDINE AND GUANIDINE DERIVATIVES, PREPARATION METHOD THEREFOR AND MEDICAL USES THEREOF | 四川科伦博泰生物医药股份有限公司 | 2019-09-26 | — | — | WO | disclosed |