Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 4/20 | 0.33 |
| ▸ | ACHE | P22303 | 4/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | PIM1 | P11309 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | ERN1 | O75460 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29654967 | 0.76 | MAPT (0.50) | CYP2A6CYP11B1CYP11B2LMNAMAPT | |
| SCHEMBL203439 | 0.76 | MAPT (0.50) | CYP2A6CYP11B1CYP11B2LMNAMAPT | |
| SCHEMBL20033064 | 0.76 | LMNA (0.40) | CYP11B1CYP11B2BCHEACHELMNA | |
| SCHEMBL6989681 | 0.74 | MAPT (0.46) | LMNAMAPTKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL524745 | 0.74 | CYP2A6 (0.43) | CYP2A6CYP11B1CYP11B2LMNAMAPT | |
| SCHEMBL13242796 | 0.73 | ALDH1A1 (0.47) | CYP2A6CYP11B1CYP11B2PTPN1LMNA | |
| SCHEMBL22590138 | 0.72 | CYP2A6 (0.40) | CYP2A6ALDH1A1ALOX15SMN1; SMN2 | |
| SCHEMBL321965 | 0.72 | CYP2A6 (0.40) | CYP2A6ALDH1A1ALOX15SMN1; SMN2 | |
| SCHEMBL21495049 | 0.70 | ALDH1A1 (0.47) | ALDH1A1 | |
| SCHEMBL540882 | 0.70 | ALDH1A1 (0.47) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2430014-A1 | ANTIVIRAL COMPOUNDS | Gilead Sciences, Inc. (US) | 2012-03-21 | — | — | EP | disclosed |
| WO-2010132601-A1 | ANTIVIRAL COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2010-11-18 | — | — | WO | disclosed |