Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 7/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.57 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.57 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.57 |
| ▸ | HTR2A | P28223 | 1/20 | 0.57 |
| ▸ | SCN1A | P35498 | 1/20 | 0.57 |
| ▸ | HTR2B | P41595 | 1/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.57 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.57 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.57 |
| ▸ | USP2 | O75604 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL22918726 | 1.00 | HRH3 (0.57) | HRH3ALDH1A1MAPK1SIGMAR1CYP1A2 | |
| SCHEMBL2024990 | 0.93 | KDM4E (0.58) | ALDH1A1CYP1A2KDM4ETSHRNPC1 | |
| SCHEMBL29615193 | 0.93 | KDM4E (0.58) | ALDH1A1CYP1A2KDM4ETSHRNPC1 | |
| SCHEMBL29615450 | 0.87 | HRH3 (0.54) | HRH3SIGMAR1KCNH2KDM4E | |
| SCHEMBL22918759 | 0.87 | HRH3 (0.54) | HRH3SIGMAR1KCNH2KDM4E | |
| SCHEMBL22918755 | 0.84 | HRH3 (0.58) | HRH3ALDH1A1SIGMAR1USP2KDM4E | |
| SCHEMBL15260249 | 0.83 | ALDH1A1 (0.57) | HRH3ALDH1A1MAPK1SIGMAR1CYP1A2 | |
| SCHEMBL22918968 | 0.80 | PDK2 (0.45) | HRH3ALDH1A1MAPK1SIGMAR1CYP1A2 | |
| SCHEMBL29615306 | 0.80 | PDK2 (0.45) | HRH3ALDH1A1MAPK1SIGMAR1CYP1A2 | |
| SCHEMBL22919001 | 0.80 | LTA4H (0.57) | ALDH1A1KDM4ESMN1; SMN2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114174293-A | 4- (imidazo [1,2-a ] pyridin-3-yl) -pyrimidine derivatives | 默克专利股份公司 | 2022-03-11 | — | — | CN | disclosed |