Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 7/20 | 0.62 |
| ▸ | CHRM1 | P11229 | 5/20 | 0.62 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.62 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.62 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.62 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.62 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.62 |
| ▸ | DRD3 | P35462 | 3/20 | 0.62 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.62 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.62 |
| ▸ | HTR2A | P28223 | 3/20 | 0.62 |
| ▸ | HRH1 | P35367 | 3/20 | 0.62 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.62 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.62 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.62 |
| ▸ | HRH2 | P25021 | 2/20 | 0.62 |
| ▸ | HTR2C | P28335 | 2/20 | 0.62 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.62 |
| ▸ | HTR2B | P41595 | 2/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL8833037 | 0.90 | LMNA (0.62) | LMNACHRM1CHRM2CYP2D6ADRA2A | |
| SCHEMBL30728008 | 0.87 | LMNA (0.58) | LMNACHRM1CHRM2CYP2D6ADRA2A | |
| SCHEMBL17724542 | 0.81 | PPARA (0.47) | LMNACYP2D6CYP1A2SMN1; SMN2CYP3A4 | |
| SCHEMBL8084866 | 0.81 | PPARA (0.47) | LMNACYP2D6CYP1A2SMN1; SMN2CYP3A4 | |
| Diphenhydramine SCHEMBL25268546 | 0.80 | SLC6A2 (0.83) | LMNACHRM1CHRM2CYP2D6ADRA2A | |
| Diphenhydramine SCHEMBL25269204 | 0.80 | SLC6A2 (0.83) | LMNACHRM1CHRM2CYP2D6ADRA2A | |
| SCHEMBL5831517 | 0.79 | GLS (0.52) | LMNACYP2D6CYP1A2TSHRCYP3A4 | |
| SCHEMBL21369008 | 0.79 | GLS (0.50) | LMNACYP2D6CYP1A2MAPK1CYP3A4 | |
| Diphenhydramine SCHEMBL29096592 | 0.79 | LMNA (0.84) | LMNACHRM1CHRM2CYP2D6ADRA2A | |
| SCHEMBL21697916 | 0.78 | LMNA (0.55) | LMNACHRM1CHRM2CYP2D6ADRA2A |
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-2011123937-A1 | KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME | UNIVERSITY HEALTH NETWORK (CA) | 2011-10-13 | — | — | WO | disclosed |