Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 4/20 | 0.47 |
| ▸ | RPS6KB1 | P23443 | 3/20 | 0.46 |
| ▸ | AURKA | O14965 | 1/20 | 0.46 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HTR6 | P50406 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 2/20 | 0.41 |
| ▸ | FSCN1 | Q16658 | 1/20 | 0.41 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.39 |
| ▸ | JAK3 | P52333 | 1/20 | 0.39 |
| ▸ | RORC | P51449 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL16628334 | 0.91 | NPC1 (0.44) | CHRM1RPS6KB1NPC1RAB9ANOD2 | |
| SCHEMBL22001750 | 0.90 | RAB9A (0.54) | CHRM1NPC1RAB9ANOD2ATM | |
| SCHEMBL19997523 | 0.89 | CHRM1 (0.48) | CHRM1NPC1RAB9ANOD2ATM | |
| SCHEMBL16628257 | 0.87 | NPC1 (0.58) | CHRM1RPS6KB1AURKANPC1RAB9A | |
| SCHEMBL21043474 | 0.87 | CHRM1 (0.53) | CHRM1NPC1RAB9ANOD2ATM | |
| SCHEMBL16628263 | 0.83 | POLB (0.56) | CHRM1RPS6KB1 | |
| SCHEMBL22001749 | 0.82 | ALDH1A1 (0.52) | CHRM1KDM4EHTR6HTR2AHTR2C | |
| SCHEMBL16628328 | 0.82 | RPS6KB1 (0.54) | CHRM1RPS6KB1AURKAAURKBHTR6 | |
| SCHEMBL21043084 | 0.82 | NPC1 (0.47) | CHRM1RPS6KB1AURKANPC1RAB9A | |
| SCHEMBL16593338 | 0.81 | KDM4E (0.40) | CHRM1ATMKDM4EHTR6HTR2A |
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-2015049574-A1 | 4-AZAINDOLE DERIVATIVES | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2015-04-09 | — | — | WO | disclosed |