Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 4/20 | 0.47 |
| ▸ | JAK2 | O60674 | 6/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.45 |
| ▸ | JAK3 | P52333 | 3/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.45 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.45 |
| ▸ | PRKCA | P17252 | 2/20 | 0.43 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | PRKCG | P05129 | 1/20 | 0.43 |
| ▸ | PRKCB | P05771 | 1/20 | 0.43 |
| ▸ | LCK | P06239 | 1/20 | 0.43 |
| ▸ | PRKCH | P24723 | 1/20 | 0.43 |
| ▸ | PRKCI | P41743 | 1/20 | 0.43 |
| ▸ | ZAP70 | P43403 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL12801680 | 0.95 | IKBKB (0.50) | IKBKBJAK2MEN1NPC1RAB9A | |
| SCHEMBL12801667 | 0.93 | IKBKB (0.47) | IKBKBJAK2MEN1NPC1RAB9A | |
| SCHEMBL12801601 | 0.92 | ABL1 (0.50) | JAK2NPC1RAB9ACDK5CDK5R1 | |
| SCHEMBL12801637 | 0.91 | IKBKB (0.44) | IKBKBJAK2MEN1NPC1RAB9A | |
| SCHEMBL1667536 | 0.87 | JAK2 (0.47) | JAK2MEN1KMT2AJAK3HDAC6 | |
| SCHEMBL12522222 | 0.87 | ABL1 (0.51) | JAK2CDK5HDAC6PRKCAEGFR | |
| SCHEMBL12801592 | 0.86 | IKBKB (0.45) | IKBKBJAK2MEN1NPC1RAB9A | |
| SCHEMBL12801109 | 0.84 | EGFR (0.47) | IKBKBJAK2MEN1NPC1RAB9A | |
| SCHEMBL12521735 | 0.84 | IKBKB (0.46) | IKBKBJAK2MEN1NPC1RAB9A | |
| SCHEMBL12801600 | 0.82 | IKBKB (0.45) | IKBKBJAK2MEN1NPC1RAB9A |
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 |