Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | INSR | P06213 | 1/20 | 0.37 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.37 |
| ▸ | ALOX5AP | P20292 | 5/20 | 0.36 |
| ▸ | FEN1 | P39748 | 5/20 | 0.36 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.36 |
| ▸ | CECR2 | Q9BXF3 | 1/20 | 0.36 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.36 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.34 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.34 |
| ▸ | CDK9 | P50750 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL519300 | 0.82 | INSR (0.38) | INSRALKALOX5APFEN1SLC22A12 | |
| SCHEMBL521529 | 0.80 | INSR (0.37) | INSRALKALOX5APFEN1SLC22A12 | |
| SCHEMBL2509793 | 0.73 | ALOX5AP (0.39) | ALOX5APFEN1SLC22A12BRD4PTGS1 | |
| SCHEMBL520253 | 0.61 | ALK (0.53) | INSRALKALOX5APFEN1SLC22A12 | |
| SCHEMBL14508939 | 0.60 | KEAP1 (0.50) | KEAP1NFE2L2GAAALOX15HTT | |
| SCHEMBL14080156 | 0.60 | ALOX5AP (0.50) | ALOX5APFEN1SLC22A12KDM1APTGS1 | |
| SCHEMBL1476351 | 0.59 | KEAP1 (0.70) | PTGS1PTGS2KEAP1NFE2L2TSHR | |
| SCHEMBL1206957 | 0.59 | KDM1A (0.54) | ALOX5APFEN1SLC22A12KDM1APTGS2 | |
| SCHEMBL29904739 | 0.58 | KEAP1 (0.65) | PTGS1PTGS2KEAP1NFE2L2KDM4E | |
| SCHEMBL2068498 | 0.58 | KEAP1 (0.65) | PTGS1PTGS2KEAP1NFE2L2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-2376491-A1 | PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS | Cephalon, Inc. (US) | 2011-10-19 | — | — | EP | disclosed |
| WO-2010071885-A1 | PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS | CEPHALON, INC. (US) | 2010-06-24 | — | — | WO | disclosed |