Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 4/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 3/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.45 |
| ▸ | GFER | P55789 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.39 |
| ▸ | GSTA1 | P08263 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14764684 | 0.86 | MGLL (0.62) | MGLLCYP1A2GFERKMT2ASMN1; SMN2 | |
| SCHEMBL30483042 | 0.86 | MGLL (0.62) | MGLLCYP1A2GFERKMT2ASMN1; SMN2 | |
| SCHEMBL14764683 | 0.86 | MGLL (0.62) | MGLLCYP1A2GFERKMT2ASMN1; SMN2 | |
| SCHEMBL17988306 | 0.82 | CYP1A2 (0.66) | MGLLCYP1A2CYP3A4CYP2D6ESR1 | |
| SCHEMBL28348198 | 0.82 | CYP1A2 (0.66) | MGLLCYP1A2CYP3A4CYP2D6ESR1 | |
| SCHEMBL25340466 | 0.78 | ESR1 (0.41) | MGLLCYP1A2ESR1ESR2KMT2A | |
| SCHEMBL17548950 | 0.77 | MGLL (0.59) | MGLLCYP1A2CYP3A4CYP2D6ESR1 | |
| SCHEMBL5896900 | 0.77 | MGLL (0.59) | MGLLCYP1A2CYP3A4CYP2D6ESR1 | |
| SCHEMBL24451314 | 0.76 | MGLL (0.66) | MGLLCYP1A2CYP3A4CYP2D6ESR1 | |
| SCHEMBL5781789 | 0.75 | ALDH1A1 (0.57) | MGLLCYP1A2CYP3A4ESR1ESR2 |
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-2013034048-A1 | SUBSTITUTED BENZOFURAN COMPOUNDS AND METHODS OF USE THEREOF FOR THE TREATMENT OF VIRAL DISEASES | MERCK SHARP & DOHME CORP. (US) | 2013-03-14 | — | — | WO | disclosed |