Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 4/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 8/20 | 0.38 |
| ▸ | ADRB1 | P08588 | 8/20 | 0.38 |
| ▸ | NR2E1 | Q9Y466 | 5/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.38 |
| ▸ | HTR2B | P41595 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | ADRB3 | P13945 | 3/20 | 0.38 |
| ▸ | HTR2A | P28223 | 3/20 | 0.38 |
| ▸ | HTR2C | P28335 | 3/20 | 0.38 |
| ▸ | HTR6 | P50406 | 3/20 | 0.38 |
| ▸ | SCN1A | P35498 | 2/20 | 0.38 |
| ▸ | SLC10A1 | Q14973 | 2/20 | 0.38 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.38 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8818397 | 0.82 | RECQL (0.48) | CYP2D6SLC6A4ALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL8818390 | 0.69 | ALDH1A1 (0.50) | CYP1A2SLC6A4ALDH1A1MAPK1HTR1B | |
| SCHEMBL15510160 | 0.68 | ALDH1A1 (0.50) | CYP1A2ALDH1A1SMN1; SMN2LMNATSHR | |
| SCHEMBL29386728 | 0.68 | ALDH1A1 (0.50) | CYP1A2ALDH1A1SMN1; SMN2LMNATSHR | |
| SCHEMBL2806149 | 0.65 | MEN1 (0.37) | CYP2D6CYP1A2ALDH1A1MAPK1DRD3 | |
| SCHEMBL11329634 | 0.64 | HRH1 (0.47) | CYP1A2ALDH1A1SMN1; SMN2LMNATSHR | |
| SCHEMBL23697045 | 0.63 | ALDH1A1 (0.53) | CYP1A2ALDH1A1SMN1; SMN2LMNATSHR | |
| SCHEMBL29584474 | 0.63 | KCNA3 (0.50) | CYP2D6CYP1A2SLC6A4ALDH1A1MAPK1 | |
| SCHEMBL2047083 | 0.63 | KCNA3 (0.50) | CYP2D6CYP1A2SLC6A4ALDH1A1MAPK1 | |
| SCHEMBL25016929 | 0.62 | RHEB (0.49) | — |
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-2012079154-A1 | SELECTIVE ESTROGEN RECEPTOR MODULATORS | DALHOUSIE UNIVERSITY (CA) | 2012-06-21 | — | — | WO | disclosed |