Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.35 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.35 |
| ▸ | CHRNG | P07510 | 1/20 | 0.35 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | CHRND | Q07001 | 1/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.34 |
| ▸ | USP2 | O75604 | 6/20 | 0.34 |
| ▸ | CASP1 | P29466 | 6/20 | 0.34 |
| ▸ | CASP7 | P55210 | 6/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 5/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11923253 | 0.85 | MAPT (0.40) | MAPTCHRNA1CHRNGCHRNB1CHRNB2 | |
| SCHEMBL8268303 | 0.82 | PTPN11 (0.40) | HTR2CHSD17B10 | |
| SCHEMBL8265891 | 0.82 | CYP1A2 (0.38) | MAPK1ALDH1A1USP2CASP1CASP7 | |
| SCHEMBL8267735 | 0.81 | POLB (0.36) | CASP1LMNAPOLBSMN1; SMN2 | |
| SCHEMBL8267721 | 0.81 | PIK3R1 (0.35) | ALDH1A1USP2CASP1CASP7CYP3A4 | |
| SCHEMBL8267731 | 0.81 | GPBAR1 (0.43) | MAPTCHRNA1CHRNGCHRNB1CHRNB2 | |
| SCHEMBL8267809 | 0.78 | MAPT (0.39) | MAPTMAPK1CYP3A4CYP2C19LMNA | |
| SCHEMBL8267717 | 0.78 | HTR2C (0.47) | MAPK1ALDH1A1USP2CASP1CASP7 | |
| SCHEMBL11923270 | 0.77 | WDR5 (0.43) | MAPK1FFAR1ALDH1A1USP2CASP1 | |
| SCHEMBL8267321 | 0.77 | TACR1 (0.37) | MAPTMAPK1ALDH1A1USP2CASP1 |
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-2006050476-A2 | PYRIMIDINE DERIVATIVES AS ION CHANNEL MODULATORS AND METHODS OF USE | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2006-05-11 | — | — | WO | disclosed |