Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SOS1 | Q07889 | 2/20 | 0.44 |
| ▸ | GNG2 | P59768 | 1/20 | 0.37 |
| ▸ | GNB1 | P62873 | 1/20 | 0.37 |
| ▸ | CDC25B | P30305 | 1/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.36 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.36 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 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 | |
|---|---|---|---|---|
| SCHEMBL19494880 | 0.87 | ABCB1 (0.45) | ABCB1KDM4ERAB9AALDH1A1HPGD | |
| SCHEMBL19494844 | 0.85 | AR (0.46) | CYP1A2ABCB1ABCG2KDM4ERAB9A | |
| SCHEMBL19494745 | 0.85 | ABCB1 (0.34) | SOS1CDC25BCYP1A1CYP1A2CYP1B1 | |
| SCHEMBL19495008 | 0.79 | ABCB1 (0.42) | ABCB1KDM4EALDH1A1HPGDMAPT | |
| SCHEMBL15356349 | 0.78 | SOS1 (0.62) | SOS1GNG2GNB1CYP1A1CYP1A2 | |
| SCHEMBL15355554 | 0.77 | MEN1 (0.48) | CYP1A2ABCB1KDM4ERAB9AALDH1A1 | |
| SCHEMBL19655005 | 0.77 | FTO (0.44) | ABCB1KDM4ERAB9AALDH1A1HPGD | |
| SCHEMBL19494774 | 0.76 | USP2 (0.53) | SOS1ABCB1KDM4EALDH1A1HPGD | |
| SCHEMBL12763951 | 0.76 | POLB (0.50) | ABCB1KDM4ERAB9AHPGDNPC1 | |
| SCHEMBL17109310 | 0.76 | ABCB1 (0.44) | ABCB1KDM4EHPGDMAPTATM |
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 |
|---|---|---|---|---|---|---|---|
| EP-3235876-A1 | QUENCHER | Wako Pure Chemical Industries, Ltd. (JP) | 2017-10-25 | — | — | EP | disclosed |