Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.32 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.32 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.32 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21626883 | 0.82 | ROCK2 (0.37) | — | |
| SCHEMBL22887584 | 0.72 | OPRK1 (0.30) | NPC1ALDH1A1GAAMAPTALOX12 | |
| SCHEMBL21626795 | 0.70 | DGAT2 (0.36) | NPC1MAPTRAB9AFGFR1FGFR4 | |
| SCHEMBL23769903 | 0.61 | HTR2A (0.31) | NPC1ALDH1A1GAAMAPTALOX12 | |
| SCHEMBL23393477 | 0.60 | PDE1B (0.33) | — | |
| SCHEMBL21598062 | 0.60 | NPC1 (0.41) | NPC1ALDH1A1GAAMAPTALOX12 | |
| SCHEMBL21626898 | 0.59 | CHEK1 (0.33) | NPC1ALDH1A1GAAMAPTALOX12 | |
| SCHEMBL21626833 | 0.59 | CYP3A4 (0.42) | FGFR1 | |
| SCHEMBL4399141 | 0.58 | GAA (0.47) | ALDH1A1GAARAB9ANPSR1 | |
| SCHEMBL22042410 | 0.57 | MAPT (0.43) | NPC1ALDH1A1GAAMAPTALOX12 |
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-2020015744-A1 | AZAINDOLE DERIVATIVE AND USE THEREOF AS FGFR AND C-MET INHIBITOR | 南京明德新药研发有限公司 | 2020-01-23 | — | — | WO | disclosed |