Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 6/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.47 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.47 |
| ▸ | CASP1 | P29466 | 2/20 | 0.47 |
| ▸ | CASP7 | P55210 | 2/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.46 |
| ▸ | AURKA | O14965 | 4/20 | 0.46 |
| ▸ | CDK2 | P24941 | 2/20 | 0.46 |
| ▸ | GSK3A | P49840 | 2/20 | 0.46 |
| ▸ | GSK3B | P49841 | 2/20 | 0.46 |
| ▸ | PLK4 | O00444 | 1/20 | 0.46 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.46 |
| ▸ | JAK2 | O60674 | 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 | |
|---|---|---|---|---|
| SCHEMBL3783305 | 0.82 | MEN1 (0.49) | USP2MAPK1TSHRCASP1CASP7 | |
| SCHEMBL3793746 | 0.81 | ADORA1 (0.35) | USP2CYP1A2MAPK1CYP3A4TSHR | |
| SCHEMBL3787718 | 0.78 | MEN1 (0.46) | USP2CYP1A2MAPK1CYP3A4TSHR | |
| SCHEMBL3782842 | 0.78 | ALDH1A1 (0.51) | USP2CYP1A2MAPK1CYP3A4TSHR | |
| SCHEMBL3785163 | 0.78 | KCNH3 (0.40) | MAPK1LMNARPS6KB1MAPK8MAPK9 | |
| SCHEMBL3789583 | 0.74 | MERTK (0.49) | USP2CYP1A2TSHRCASP1CASP7 | |
| SCHEMBL3787698 | 0.74 | PDE5A (0.46) | LMNAMAPK8MAPK9KMT2AKDM4E | |
| SCHEMBL3777980 | 0.74 | ADORA1 (0.43) | MAP4K4MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL3782859 | 0.73 | KCNH3 (0.47) | CDK2KCNH3ADORA2BADORA1 | |
| SCHEMBL13286144 | 0.69 | PTGS2 (0.47) | PTGS2 |
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-2010083645-A1 | PYRIMIDO[5,4-e][1,2,4]TRIAZINES AND USES THEREOF | SHANGHAI TARGETDRUG CO., LTD (CN) | 2010-07-29 | — | — | WO | disclosed |