Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SCN10A | Q9Y5Y9 | 2/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.35 |
| ▸ | SCN1A | P35498 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.35 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.35 |
| ▸ | MALT1 | Q9UDY8 | 5/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3301651 | 0.87 | CYP3A4 (0.36) | GRM2KMT2APLA2G2ACYP3A4PSIP1 | |
| SCHEMBL15186229 | 0.86 | PSIP1 (0.47) | GAARAB9ASCN10AGRM2SCN1A | |
| SCHEMBL10284000 | 0.85 | KMT2A (0.35) | RAB9AGRM2MEN1KMT2APLA2G2A | |
| SCHEMBL27928083 | 0.83 | CNR1 (0.39) | GAARAB9ASCN10AGRM2SCN1A | |
| SCHEMBL10284001 | 0.83 | PLA2G2A (0.35) | GRM2SCN9AKMT2APLA2G2ACYP3A4 | |
| SCHEMBL10283998 | 0.83 | EGLN1 (0.35) | KMT2ANFKB1PLA2G2ACYP3A4SMN1; SMN2 | |
| SCHEMBL3295271 | 0.82 | CYP3A4 (0.35) | RAB9AMEN1KMT2APLA2G2ACYP3A4 | |
| SCHEMBL3296258 | 0.81 | CYP3A4 (0.33) | GRM2PLA2G2ACYP3A4PSIP1KDM4E | |
| SCHEMBL10283992 | 0.80 | KDM4E (0.39) | GAACYP3A4PSIP1KDM4E | |
| SCHEMBL3312316 | 0.80 | DHODH (0.33) | PLA2G2ACYP3A4PSIP1KDM4EDHODH |
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-2012003498-A1 | 2 -QUINOLINYL- ACETIC ACID DERIVATIVES AS HIV ANTIVIRAL COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2012-01-05 | — | — | WO | disclosed |