Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRC | P12931 | 3/20 | 0.44 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.41 |
| ▸ | KDR | P35968 | 2/20 | 0.39 |
| ▸ | CDK9 | P50750 | 2/20 | 0.38 |
| ▸ | ACHE | P22303 | 2/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | CDK1 | P06493 | 1/20 | 0.37 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.37 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.37 |
| ▸ | FLT1 | P17948 | 1/20 | 0.37 |
| ▸ | FLT4 | P35916 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.35 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10169131 | 0.91 | SRC (0.54) | SRCCCNT1KDRCDK9ACHE | |
| SCHEMBL255043 | 0.79 | HTR2A (0.45) | SRCKCNH2HTR2ATUBB4ATUBB | |
| SCHEMBL254301 | 0.79 | SRC (0.65) | SRCCCNT1PTGDR2TUBB4ATUBB | |
| SCHEMBL253853 | 0.79 | SRC (0.66) | SRCKDRACHEAURKACDK1 | |
| SCHEMBL254619 | 0.78 | SRC (0.50) | SRCCCNT1KDRPTGDR2AURKA | |
| SCHEMBL254375 | 0.78 | SRC (0.64) | SRCPTGDR2TUBB4ATUBBTUBA3C | |
| SCHEMBL255064 | 0.76 | SRC (0.65) | SRCPTGDR2KCNH2HTR2ATUBB4A | |
| SCHEMBL14044701 | 0.75 | CXCR1 (0.43) | SRCACHEMAOAMAOBKCNH2 | |
| SCHEMBL254553 | 0.75 | SRC (0.57) | SRCTUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL13096514 | 0.75 | GAK (0.38) | SRCKDRKCNH2TUBB4ATUBB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011129936-A9 | COMPOSITIONS AND METHODS FOR THE PREVENTION AND TREATMENT OF CANCER | KINEX PHARMACEUTICALS, LLC (US) | 2012-03-08 | — | — | WO | disclosed |
| WO-2011129936-A2 | COMPOSITIONS AND METHODS FOR THE PREVENTION AND TREATMENT OF CANCER | KINEX PHARMACEUTICALS, LLC (US) | 2011-10-20 | — | — | WO | disclosed |