Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.43 |
| ▸ | HTR3B | O95264 | 1/20 | 0.43 |
| ▸ | HTR3A | P46098 | 1/20 | 0.43 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.43 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.43 |
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CPS1 | P31327 | 5/20 | 0.42 |
| ▸ | SSTR2 | P30874 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | KYAT1 | Q16773 | 1/20 | 0.39 |
| ▸ | KYAT3 | Q6YP21 | 1/20 | 0.39 |
| ▸ | AADAT | Q8N5Z0 | 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 | |
|---|---|---|---|---|
| SCHEMBL30815847 | 1.00 | ACACB (0.47) | ACACBDRD2DRD3HTR3EHTR3B | |
| SCHEMBL21397269 | 0.84 | ACACB (0.44) | ACACBHTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL11906870 | 0.83 | KDM4E (0.47) | DRD2DRD3HTR3EHTR3BHTR3A | |
| SCHEMBL8129610 | 0.82 | ALDH1A1 (0.51) | HTR3EHTR3BHTR3AHTR3DHTR3C | |
| SCHEMBL8138147 | 0.81 | ALDH1A1 (0.50) | HTR3EHTR3BHTR3AHTR3DHTR3C | |
| SCHEMBL27474183 | 0.80 | GAA (0.42) | ACACBGAAKMT2A | |
| SCHEMBL13419247 | 0.80 | SSTR2 (0.43) | ACACBLMNATSHRSSTR2GAA | |
| SCHEMBL14922713 | 0.80 | LMNA (0.54) | DRD2DRD3HTR3EHTR3BHTR3A | |
| SCHEMBL4539952 | 0.79 | ALDH1A1 (0.45) | ACACBLMNAKDM4EGAAMAPK1 | |
| SCHEMBL2768723 | 0.78 | HTR3A (0.69) | DRD2DRD3HTR3EHTR3BHTR3A |
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-112574176-B | Heteroaryl compound and application thereof | 隆泰申医药科技(南京) 有限公司 | 2024-03-15 | — | — | CN | disclosed |
| WO-2021057696-A1 | HETEROARYL COMPOUND AND APPLICATION THEREOF | 隆泰申医药科技(南京)有限公司 | 2021-04-01 | — | — | WO | disclosed |
| CN-112574176-A | Heteroaryl compound and application thereof | 隆泰申医药科技(南京) 有限公司 | 2021-03-30 | — | — | 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 |