Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | ACACB | O00763 | 2/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.49 |
| ▸ | HTR7 | P34969 | 1/20 | 0.49 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.48 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.47 |
| ▸ | NQO1 | P15559 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL27778741 | 0.85 | KMT2A (0.54) | HTTLMNAL3MBTL1ALDH1A1MAPT | |
| SCHEMBL27590309 | 0.85 | SMN1; SMN2 (0.59) | ALDH1A1MAPT | |
| SCHEMBL28298039 | 0.85 | ALDH1A1 (0.57) | LMNAL3MBTL1ACACBADORA3HTR2A | |
| SCHEMBL22621344 | 0.84 | L3MBTL1 (0.50) | LMNAL3MBTL1ADORA3HTR2AHTR7 | |
| Ethyl Propionate SCHEMBL23581110 | 0.84 | KMT2A (0.56) | LMNAL3MBTL1ALDH1A1MAPT | |
| SCHEMBL10030185 | 0.84 | HTT (0.64) | HTTLMNAL3MBTL1MAPT | |
| SCHEMBL22489202 | 0.83 | FFAR1 (0.60) | HTTLMNAL3MBTL1ALDH1A1FFAR1 | |
| SCHEMBL28285615 | 0.83 | NPC1 (0.53) | HTTLMNAL3MBTL1POLBSLC5A1 | |
| SCHEMBL27728967 | 0.82 | HTT (0.59) | HTTLMNAL3MBTL1ALDH1A1 | |
| Ethyl Propionate SCHEMBL23581111 | 0.81 | CYP4F2 (0.51) | LMNAL3MBTL1ALDH1A1MAPT |
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-110317173-A | Amidopyrazole class compound as FGFR irreversible inhibitor | 中国科学院上海有机化学研究所 | 2019-10-11 | — | — | CN | disclosed |
| CN-108530361-A | A kind of synthesis technology of 5- [2- (3,5- Dimethoxyphenyls) ethyl] -1H- pyrazoles -3- amine | 重庆医药高等专科学校 | 2018-09-14 | — | — | CN | disclosed |