Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIT | P10721 | 4/20 | 0.57 |
| ▸ | MAP3K11 | Q16584 | 4/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.57 |
| ▸ | NTRK1 | P04629 | 5/20 | 0.51 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.48 |
| ▸ | CLK1 | P49759 | 2/20 | 0.48 |
| ▸ | DYRK2 | Q92630 | 2/20 | 0.48 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.48 |
| ▸ | AXL | P30530 | 1/20 | 0.46 |
| ▸ | CDK8 | P49336 | 1/20 | 0.46 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.46 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.46 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.46 |
| ▸ | CDK2 | P24941 | 2/20 | 0.46 |
| ▸ | CDK9 | P50750 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.46 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7905041 | 0.91 | NTRK1 (0.63) | KITMAP3K11CYP3A4CYP2D6NTRK1 | |
| SCHEMBL7908989 | 0.90 | MAP3K11 (0.63) | KITMAP3K11CYP3A4CYP2D6NTRK1 | |
| SCHEMBL7907491 | 0.87 | AXL (0.64) | KITMAP3K11NTRK1AXLCDK8 | |
| SCHEMBL7910407 | 0.84 | MAP3K11 (0.47) | KITMAP3K11NTRK1DYRK1ACLK1 | |
| SCHEMBL7899036 | 0.84 | KIT (0.63) | KITMAP3K11NTRK1DYRK1ALRRK2 | |
| SCHEMBL7910174 | 0.83 | MAP3K11 (0.60) | KITMAP3K11DYRK1APIK3CA | |
| SCHEMBL7906025 | 0.83 | MAP3K11 (0.69) | KITMAP3K11NTRK1DYRK1ACLK1 | |
| SCHEMBL12068189 | 0.82 | DYRK1A (0.56) | KITMAP3K11NTRK1DYRK1ACLK1 | |
| SCHEMBL7909336 | 0.82 | CLK1 (0.65) | MAP3K11NTRK1DYRK1ACLK1DYRK2 | |
| SCHEMBL7912984 | 0.82 | MAP3K11 (0.73) | MAP3K11CYP3A4CYP2D6NTRK1DYRK1A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011149950-A2 | BICYCLIC HETEROARYL KINASE INHIBITORS AND METHODS OF USE | UNIVERSITY OF ROCHESTER (US) | 2011-12-01 | — | — | WO | disclosed |
| WO-2010068483-A2 | MLK INHIBITORS AND METHODS OF USE | UNIVERSITY OF ROCHESTER (US) | 2010-06-17 | — | — | WO | disclosed |