Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR7 | Q9NYK1 | 3/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | RXRA | P19793 | 1/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | KDM5A | P29375 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19102048 | 0.84 | DDX3X (0.41) | TLR7CNR1CNR2ALDH1A1MEN1 | |
| SCHEMBL27702044 | 0.83 | CNR2 (0.46) | TLR7CNR1CNR2ALDH1A1MEN1 | |
| SCHEMBL2364213 | 0.80 | NPC1 (0.53) | TLR7CNR1CNR2ALDH1A1MEN1 | |
| SCHEMBL27742966 | 0.79 | CNR1 (0.61) | TLR7CNR1CNR2ALDH1A1MEN1 | |
| SCHEMBL27676098 | 0.78 | CNR1 (0.45) | TLR7CNR1CNR2ALDH1A1MEN1 | |
| SCHEMBL27742972 | 0.76 | NPC1 (0.51) | TLR7CNR1CNR2ALDH1A1MEN1 | |
| SCHEMBL19731925 | 0.76 | MIF (0.46) | TLR7CNR1CNR2ALDH1A1MEN1 | |
| SCHEMBL27702016 | 0.76 | CNR2 (0.48) | TLR7CNR1CNR2MEN1KMT2A | |
| SCHEMBL27682759 | 0.76 | NPC1 (0.49) | TLR7CNR1CNR2MEN1KMT2A | |
| SCHEMBL4054662 | 0.76 | CNR1 (0.45) | TLR7CNR1CNR2ALDH1A1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102026985-A | Quinazoline derivatives as RAF kinase modulators and methods and uses thereof | AMBIT BIOSCIENCES CORPORATON | 2011-04-20 | — | — | CN | disclosed |