Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AXL | P30530 | 1/20 | 0.36 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.33 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.33 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | FEN1 | P39748 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | RET | P07949 | 1/20 | 0.31 |
| ▸ | KDR | P35968 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.31 |
| ▸ | RHEB | Q15382 | 1/20 | 0.31 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.31 |
| ▸ | TUBB | P07437 | 2/20 | 0.31 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.31 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7705773 | 0.82 | ALDH1A1 (0.44) | AXLAURKAPARP1ALDH1A1RHEB | |
| SCHEMBL28329874 | 0.68 | AXL (0.47) | AXLAURKAPARP1ADORA2AADORA1 | |
| SCHEMBL7704641 | 0.68 | GSK3B (0.43) | MAPK13MAPK12MAPK11MAPK14MAPT | |
| SCHEMBL14739411 | 0.68 | AXL (0.36) | AXLAURKAPARP1FEN1MAPT | |
| SCHEMBL7714731 | 0.65 | TUBB4A (0.47) | AURKAMAPK14MAPTALDH1A1TUBB4A | |
| SCHEMBL7705212 | 0.65 | CYP19A1 (0.44) | MAPK13MAPK12MAPK11MAPK14MAPT | |
| SCHEMBL7714695 | 0.65 | KDM4E (0.45) | MAPK13MAPK12MAPK11MAPK14MAPT | |
| SCHEMBL14753469 | 0.64 | RHEB (0.39) | AURKAMAPK13MAPK12MAPK11MAPK14 | |
| SCHEMBL7712958 | 0.64 | RHEB (0.39) | MAPK13MAPK12MAPK11MAPK14MAPT | |
| SCHEMBL4411780 | 0.64 | ADORA2A (0.50) | AXLAURKAPARP1MAPK13MAPK12 |
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-2011140164-A1 | AZA-INDOLE DERIVATIVES USEFUL AS MODULATORS OF FAAH | MERCK SHARP & DOHME CORP. (US) | 2011-11-10 | — | — | WO | disclosed |