Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 1/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 4/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | JAK1 | P23458 | 1/20 | 0.36 |
| ▸ | JAK3 | P52333 | 1/20 | 0.36 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.36 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.36 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.36 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.36 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.36 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8125415 | 0.98 | CHRM5 (0.41) | GRM5CHRM5ADRA2CTSHRTP53 | |
| SCHEMBL30341016 | 0.98 | CHRM5 (0.41) | GRM5CHRM5ADRA2CTSHRTP53 | |
| SCHEMBL14836906 | 0.91 | CA1 (0.42) | GRM5TSHRHPGDCA1CA2 | |
| SCHEMBL626217 | 0.88 | JAK2 (0.42) | GRM5TSHRHPGDCA1CA2 | |
| SCHEMBL27034818 | 0.84 | JAK2 (0.42) | GRM5TSHRTP53JAK2JAK1 | |
| SCHEMBL27075429 | 0.82 | JAK2 (0.41) | GRM5CHRM5ADRA2CTSHRJAK2 | |
| SCHEMBL15225979 | 0.82 | TSHR (0.46) | GRM5TSHRPOLBALDH1A1L3MBTL1 | |
| SCHEMBL2424972 | 0.79 | JAK2 (0.42) | GRM5TSHRJAK2JAK1JAK3 | |
| SCHEMBL8280866 | 0.79 | HSD11B1 (0.46) | GRM5TSHRTP53POLBHTR1A | |
| SCHEMBL20600247 | 0.78 | KMO (0.39) | GRM5TSHRHPGDCA1CA2 |
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-3141252-A1 | INHIBITORS OF INFLUENZA VIRUSES REPLICATION | Vertex Pharmaceuticals Inc. (US) | 2017-03-15 | — | — | EP | disclosed |
| WO-2010148197-A1 | INHIBITORS OF INFLUENZA VIRUSES REPLICATION | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2010-12-23 | — | — | WO | disclosed |