Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 5/20 | 0.50 |
| ▸ | BCR | P11274 | 5/20 | 0.50 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.50 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.50 |
| ▸ | EGFR | P00533 | 2/20 | 0.50 |
| ▸ | PRKCA | P17252 | 1/20 | 0.50 |
| ▸ | SRC | P12931 | 1/20 | 0.50 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.49 |
| ▸ | PDPK1 | O15530 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | KDR | P35968 | 2/20 | 0.48 |
| ▸ | JAK2 | O60674 | 2/20 | 0.47 |
| ▸ | FLT3 | P36888 | 1/20 | 0.47 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.46 |
| ▸ | CAMKK1 | Q8N5S9 | 1/20 | 0.45 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.45 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.45 |
| ▸ | MET | P08581 | 1/20 | 0.45 |
| ▸ | MERTK | Q12866 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL12801676 | 0.92 | AURKB (0.55) | PDGFRACDK5NPC1RAB9AKDR | |
| SCHEMBL12801322 | 0.91 | GSK3B (0.49) | ABL1BCRPDGFRBPDGFRAEGFR | |
| SCHEMBL12801341 | 0.90 | GSK3B (0.49) | PDGFRACDK5NPC1RAB9AKDR | |
| SCHEMBL12274595 | 0.88 | GSK3B (0.48) | ABL1BCRPDGFRBPDGFRAEGFR | |
| SCHEMBL12801304 | 0.85 | ABL1 (0.58) | ABL1BCRPDGFRBPDGFRAEGFR | |
| SCHEMBL12801096 | 0.85 | JAK2 (0.61) | ABL1BCRPDGFRBPDGFRAEGFR | |
| SCHEMBL12801331 | 0.83 | CCNC (0.48) | CDK5JAK2CDK2 | |
| SCHEMBL12522222 | 0.83 | ABL1 (0.51) | ABL1BCRPDGFRBPDGFRAEGFR | |
| SCHEMBL12801324 | 0.83 | PDPK1 (0.59) | ABL1BCRPDGFRBPDGFRAEGFR | |
| SCHEMBL12521964 | 0.82 | CCNC (0.47) | CDK5JAK2CDK2 |
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-2011046970-A1 | AMINO - PYRIMIDINE COMPOUNDS AS INHIBITORS OF TBKL AND/OR IKK EPSILON | MYREXIS, INC. (US) | 2011-04-21 | — | — | WO | disclosed |