Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | SCN1A | P35498 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.47 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL197295 | 0.88 | GLA (0.42) | KEAP1SMN1; SMN2ALDH1A1LMNAKDM4E | |
| SCHEMBL5946012 | 0.82 | HRH3 (0.46) | SMN1; SMN2HRH3MAPK1CYP1A2ALDH1A1 | |
| SCHEMBL15718696 | 0.82 | HRH3 (0.41) | SMN1; SMN2HRH3MAPK1CYP1A2ALDH1A1 | |
| SCHEMBL22313539 | 0.81 | KEAP1 (0.48) | KEAP1SMN1; SMN2HRH3MAPK1CYP1A2 | |
| SCHEMBL5251326 | 0.80 | HRH3 (0.50) | SMN1; SMN2HRH3MAPK1CYP1A2ALDH1A1 | |
| SCHEMBL5858594 | 0.78 | PAOX (0.43) | HRH3ALDH1A1SIGMAR1USP2KDM4E | |
| SCHEMBL22151462 | 0.78 | HRH3 (0.49) | KEAP1SMN1; SMN2HRH3MAPK1CYP1A2 | |
| SCHEMBL12299330 | 0.77 | HSD17B10 (0.51) | SMN1; SMN2ALDH1A1KDM4ETSHR | |
| SCHEMBL5293921 | 0.77 | KEAP1 (0.58) | KEAP1SMN1; SMN2HRH3MAPK1CYP1A2 | |
| SCHEMBL272713 | 0.77 | CXCR4 (0.46) | SMN1; SMN2HRH3ALDH1A1SIGMAR1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991011448-A1 | THERAPEUTIC AGENTS | THE BOOTS COMPANY PLC (GB) | 1991-08-08 | — | — | WO | disclosed |