Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT2 | P31751 | 5/20 | 0.50 |
| ▸ | AKT1 | P31749 | 2/20 | 0.50 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.46 |
| ▸ | CHEK2 | O96017 | 3/20 | 0.46 |
| ▸ | ABL1 | P00519 | 1/20 | 0.46 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | PIM1 | P11309 | 2/20 | 0.38 |
| ▸ | PIM3 | Q86V86 | 2/20 | 0.38 |
| ▸ | PIM2 | Q9P1W9 | 2/20 | 0.38 |
| ▸ | ILK | Q13418 | 1/20 | 0.37 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.37 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.37 |
| ▸ | FEN1 | P39748 | 1/20 | 0.36 |
| ▸ | AURKA | O14965 | 1/20 | 0.36 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.36 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.36 |
| ▸ | TPX2 | Q9ULW0 | 1/20 | 0.36 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL3740850 | 0.80 | AKT2 (0.70) | AKT2AKT1CHEK1CHEK2ABL1 | |
| SCHEMBL12204196 | 0.77 | AKT2 (0.50) | AKT2AKT1CHEK1CHEK2ABL1 | |
| SCHEMBL12203913 | 0.77 | AKT2 (0.50) | AKT2AKT1CHEK1CHEK2ABL1 | |
| SCHEMBL26953475 | 0.77 | AKT2 (0.50) | AKT2AKT1CHEK1CHEK2ABL1 | |
| Hydrochloric Acid SCHEMBL28973063 | 0.77 | AKT2 (0.67) | AKT2AKT1CHEK1CHEK2ABL1 | |
| SCHEMBL6196346 | 0.75 | — | — | |
| SCHEMBL29638874 | 0.73 | AKT2 (0.56) | AKT2AKT1CHEK1CHEK2ABL1 | |
| SCHEMBL15044972 | 0.72 | AKT1 (0.45) | AKT2AKT1CHEK1CHEK2ABL1 | |
| SCHEMBL26950615 | 0.72 | AKT1 (0.45) | AKT2AKT1CHEK1CHEK2ABL1 | |
| SCHEMBL29533228 | 0.72 | AKT2 (0.61) | AKT2AKT1CHEK1CHEK2ABL1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2229356-B1 | 1,2-DISUBSTITUTED-4-BENZYLAMINO-PYRROLIDINE DERIVATIVES AS CETP INHIBITORS USEFUL FOR THE TREATMENT OF DISEASES SUCH AS HYPERLI PIDEMIA OR ARTERIOSCLEROSIS | NOVARTIS AG (CH) | 2011-10-12 | — | — | EP | disclosed |