Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.57 |
| ▸ | GSK3B | P49841 | 3/20 | 0.55 |
| ▸ | PLK1 | P53350 | 1/20 | 0.52 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.49 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.49 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.49 |
| ▸ | DRD3 | P35462 | 1/20 | 0.49 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.49 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.47 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10730260 | 0.86 | ALDH1A1 (0.55) | ALDH1A1PLK1CHRM2CYP2D6ADRA2B | |
| SCHEMBL9644843 | 0.82 | GSK3B (0.76) | ALDH1A1GSK3BTDP1LMNA | |
| SCHEMBL3129690 | 0.81 | ALDH1A1 (0.59) | ALDH1A1PLK1CHRM2CYP2D6ADRA2B | |
| SCHEMBL10747854 | 0.80 | GSK3B (0.52) | ALDH1A1GSK3BSMN1; SMN2CYP2C9LMNA | |
| SCHEMBL8385131 | 0.79 | ALDH1A1 (0.57) | ALDH1A1PLK1CHRM2CYP2D6ADRA2B | |
| SCHEMBL19520440 | 0.78 | ALDH1A1 (0.55) | ALDH1A1PLK1CHRM2CYP2D6ADRA2B | |
| SCHEMBL9559796 | 0.78 | ALDH1A1 (0.55) | ALDH1A1PLK1CHRM2CYP2D6ADRA2B | |
| SCHEMBL16868406 | 0.78 | ALDH1A1 (0.55) | ALDH1A1PLK1CHRM2CYP2D6ADRA2B | |
| SCHEMBL3362947 | 0.77 | GSK3B (0.51) | ALDH1A1GSK3BSMN1; SMN2MAPTTDP1 | |
| SCHEMBL23512351 | 0.76 | ALDH1A1 (0.53) | ALDH1A1PLK1CHRM2CYP2D6ADRA2B |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010046780-A2 | ANTI VIRAL COMPOUNDS | INSTITUT PASTEUR KOREA (KR) | 2010-04-29 | — | — | WO | disclosed |
| WO-2010046780-A2 | ANTI VIRAL COMPOUNDS | INSTITUT PASTEUR KOREA (KR) | 2010-04-29 | — | — | WO | disclosed |