Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1F | O60840 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.42 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.37 |
| ▸ | LTA4H | P09960 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28044532 | 0.73 | SLC6A4 (0.36) | KDM4EALDH1A1LMNAHRH3 | |
| SCHEMBL1009297 | 0.72 | MAPT (0.54) | CHRNB2CHRNA4KDM4EALDH1A1LMNA | |
| SCHEMBL589802 | 0.72 | CHRNB2 (0.49) | CHRNB2CHRNA4KDM4EALDH1A1LMNA | |
| SCHEMBL591036 | 0.71 | CHRNB2 (0.37) | CHRNB2CHRNA4KDM4EALDH1A1LMNA | |
| SCHEMBL589768 | 0.69 | CHRNB2 (0.58) | KCNH2CHRNB2CHRNA4KDM4EALDH1A1 | |
| SCHEMBL4360471 | 0.68 | GSR (0.37) | CHRNB2CHRNA4KDM4EALDH1A1LMNA | |
| SCHEMBL158044 | 0.67 | HRH3 (0.58) | CHRNB2CHRNA4KDM4EALDH1A1MAPT | |
| SCHEMBL28044536 | 0.67 | HTR7 (0.33) | — | |
| SCHEMBL28044453 | 0.67 | HTR7 (0.33) | — | |
| SCHEMBL195978 | 0.66 | KIF11 (0.42) | KDM4EALDH1A1MAOAKEAP1 |
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-101594862-B | Substituted indazole derivatives as kinase inhibitors | NERVIANO MEDICAL SCIENCES S.R.L. (IT) | 2015-11-25 | — | — | CN | disclosed |