Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.36 |
| ▸ | MTOR | P42345 | 2/20 | 0.34 |
| ▸ | PGK1 | P00558 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | AKT1 | P31749 | 1/20 | 0.34 |
| ▸ | AKT2 | P31751 | 1/20 | 0.34 |
| ▸ | GRM4 | Q14833 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.33 |
| ▸ | GRM8 | O00222 | 1/20 | 0.33 |
| ▸ | PIM1 | P11309 | 1/20 | 0.33 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.33 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.33 |
| ▸ | APEX1 | P27695 | 1/20 | 0.33 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.33 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.33 |
| ▸ | KDM5A | P29375 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL26242523 | 0.70 | KCNH2 (0.40) | KDM4EALDH1A1ADORA2AADORA1MTOR | |
| SCHEMBL13160088 | 0.69 | KDM5B (0.38) | KDM4EALDH1A1LMNAPIM1PIM3 | |
| SCHEMBL19003127 | 0.66 | KCNH2 (0.43) | KDM4EALDH1A1ADORA2AADORA1KCNH2 | |
| SCHEMBL10272396 | 0.66 | AKT2 (0.42) | AKT1AKT2PIM1PIM3PIM2 | |
| SCHEMBL21193154 | 0.66 | KDM4E (0.42) | KDM4EALDH1A1ADORA2AADORA1MTOR | |
| SCHEMBL21193333 | 0.65 | KCNH2 (0.41) | KDM4EALDH1A1ADORA2AADORA1MTOR | |
| SCHEMBL19914001 | 0.65 | PIM1 (0.39) | KDM4EALDH1A1KCNH2AKT1AKT2 | |
| SCHEMBL25675415 | 0.64 | CDC7 (0.34) | KDM4EALDH1A1KDM5AHSD17B10KDM5B | |
| SCHEMBL16049353 | 0.64 | PDPK1 (0.40) | MTORMAPK1 | |
| SCHEMBL14983683 | 0.63 | MAPK1 (0.50) | KDM4EALDH1A1KCNH2AKT1AKT2 |
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-2010117425-A1 | CERTAIN SUBSTITUTED PYRIMIDINES, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS FOR THEIR USE | BIOGEN IDEC MA INC. (US) | 2010-10-14 | — | — | WO | disclosed |