Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 4/20 | 0.46 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.43 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 3/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.39 |
| ▸ | ESRRA | P11474 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | RXRA | P19793 | 2/20 | 0.37 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL30518891 | 0.78 | NPC1 (0.45) | NOTUMFGFR1ALDH1A1 | |
| SCHEMBL16180356 | 0.78 | NPC1 (0.45) | NOTUMFGFR1ALDH1A1 | |
| SCHEMBL31174791 | 0.75 | EPHX2 (0.54) | NOTUMFGFR1ALDH1A1 | |
| SCHEMBL28596249 | 0.75 | EPHX2 (0.54) | NOTUMFGFR1ALDH1A1 | |
| SCHEMBL27913803 | 0.74 | FGFR1 (0.45) | FGFR1ALDH1A1 | |
| SCHEMBL28600542 | 0.71 | P2RX7 (0.38) | NOTUMP2RX7AR | |
| SCHEMBL28049609 | 0.70 | POLB (0.43) | ALDH1A1 | |
| SCHEMBL29935788 | 0.70 | KAT6A (0.44) | FGFR1ALDH1A1MAOAMAOB | |
| SCHEMBL28218716 | 0.69 | GABRA2 (0.43) | NOTUMP2RX7ARALDH1A1 | |
| SCHEMBL4536618 | 0.68 | NOTUM (0.63) | NOTUMFGFR1KEAP1ALDH1A1 |
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-106459051-A | Macrocyclic FXIA Inhibitors Containing Heterocyclic Groups | 百时美施贵宝公司 | 2017-02-22 | — | — | CN | disclosed |