Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 6/20 | 0.46 |
| ▸ | CCNT1 | O60563 | 3/20 | 0.43 |
| ▸ | CDK9 | P50750 | 3/20 | 0.43 |
| ▸ | CDK2 | P24941 | 1/20 | 0.42 |
| ▸ | JAK2 | O60674 | 7/20 | 0.41 |
| ▸ | JAK3 | P52333 | 6/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | CYP2C8 | P10632 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.41 |
| ▸ | JAK1 | P23458 | 3/20 | 0.41 |
| ▸ | TYK2 | P29597 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.41 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.41 |
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 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 | |
|---|---|---|---|---|
| SCHEMBL4697229 | 1.00 | NTRK1 (0.46) | NTRK1CCNT1CDK9CDK2JAK2 | |
| SCHEMBL4696578 | 0.84 | NTRK1 (0.59) | NTRK1JAK2JAK3 | |
| SCHEMBL4696343 | 0.82 | JAK2 (0.50) | NTRK1CCNT1CDK9CDK2JAK2 | |
| SCHEMBL4696346 | 0.82 | JAK2 (0.50) | NTRK1CCNT1CDK9CDK2JAK2 | |
| SCHEMBL3137662 | 0.82 | NTRK1 (0.50) | NTRK1CCNT1CDK9CDK2JAK2 | |
| SCHEMBL3137642 | 0.82 | NTRK1 (0.50) | NTRK1CCNT1CDK9CDK2JAK2 | |
| SCHEMBL4694101 | 0.78 | NTRK1 (0.60) | NTRK1JAK2JAK3CYP3A4CYP2C8 | |
| SCHEMBL4694110 | 0.78 | NTRK1 (0.60) | NTRK1JAK2JAK3CYP3A4CYP2C8 | |
| SCHEMBL2568696 | 0.77 | NTRK1 (0.52) | NTRK1CCNT1CDK9CDK2JAK2 | |
| SCHEMBL2568019 | 0.77 | NTRK1 (0.54) | NTRK1CCNT1CDK9CDK2JAK2 |
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-1853588-B1 | CHEMICAL COMPOUNDS | ASTRAZENECA AB (SE) | 2008-06-18 | — | — | EP | disclosed |