Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT2 | P31751 | 2/20 | 0.41 |
| ▸ | AKT1 | P31749 | 1/20 | 0.41 |
| ▸ | FYN | P06241 | 1/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.38 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.38 |
| ▸ | TPX2 | Q9ULW0 | 1/20 | 0.38 |
| ▸ | KDM4A | O75164 | 1/20 | 0.37 |
| ▸ | KDM4B | O94953 | 1/20 | 0.37 |
| ▸ | KDM5C | P41229 | 1/20 | 0.37 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.37 |
| ▸ | ACVR1B | P36896 | 1/20 | 0.37 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.35 |
| ▸ | FEN1 | P39748 | 1/20 | 0.35 |
| ▸ | KCNA5 | P22460 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL320140 | 0.77 | ADORA2A (0.48) | KDM4AKDM4BKDM5CKDM5BACVR1B | |
| SCHEMBL361246 | 0.77 | MAPK1 (0.39) | AKT2AKT1AURKAAURKBACVR1B | |
| SCHEMBL20534083 | 0.73 | AKT2 (0.50) | AKT2AKT1ROCK2MAPK1 | |
| SCHEMBL27887721 | 0.71 | ADORA2A (0.43) | — | |
| SCHEMBL19028096 | 0.70 | AKT1 (0.46) | AKT2AKT1FYNAURKAAURKB | |
| SCHEMBL30608796 | 0.70 | AKT1 (0.46) | AKT2AKT1FYNAURKAAURKB | |
| SCHEMBL510032 | 0.70 | LRRK2 (0.51) | AKT2AKT1FYNAURKAAURKB | |
| Hydrochloric Acid SCHEMBL21806028 | 0.69 | LRRK2 (0.50) | AKT2AKT1FYNAURKAAURKB | |
| SCHEMBL21359446 | 0.69 | KDM4E (0.46) | AKT2AKT1FYNAURKAAURKB | |
| SCHEMBL2551850 | 0.69 | ADORA2A (0.56) | MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8097594-B2 | Macrolides and ketolides having antimicrobial activity | WOCKHARDT LTD. (IN) | 2012-01-17 | — | — | US | disclosed |