Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | PIM1 | P11309 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | AKT1 | P31749 | 1/20 | 0.40 |
| ▸ | AKT2 | P31751 | 1/20 | 0.40 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.39 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.39 |
| ▸ | PLK4 | O00444 | 2/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.39 |
| ▸ | FLT3 | P36888 | 2/20 | 0.39 |
| ▸ | CSNK1A1 | P48729 | 2/20 | 0.39 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.39 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.39 |
| ▸ | CSF1R | P07333 | 1/20 | 0.39 |
| ▸ | RET | P07949 | 1/20 | 0.39 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30753661 | 0.86 | KDM4E (0.61) | KDM4ETDP1PIM1AKT1AKT2 | |
| SCHEMBL4186883 | 0.78 | KDM4E (0.65) | PARP1KDM4ETDP1RAB9ACSNK1A1 | |
| SCHEMBL22732136 | 0.78 | PARP1 (0.43) | PARP1KDM4ETDP1RAB9ACSNK1A1 | |
| SCHEMBL29916420 | 0.77 | KDM4E (0.55) | PARP1KDM4ETDP1RAB9ADYRK1B | |
| SCHEMBL945856 | 0.77 | KDM4E (0.55) | PARP1KDM4ETDP1RAB9ADYRK1B | |
| SCHEMBL4512695 | 0.76 | BCAT2 (0.58) | RAB9AAKT1AKT2PLK4MAP4K4 | |
| SCHEMBL1571384 | 0.76 | MKNK1 (0.55) | PARP1KDM4ETDP1MKNK2 | |
| SCHEMBL30387828 | 0.76 | LRRK2 (0.38) | PIM1AKT1AKT2IKBKETBK1 | |
| SCHEMBL29575496 | 0.76 | MKNK1 (0.55) | PARP1KDM4ETDP1MKNK2 | |
| SCHEMBL19520186 | 0.76 | PARP1 (0.47) | PARP1KDM4ETDP1RAB9AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101023063-A | Azine-carboxamides as anti-cancer agents | ASTRAZENECA AB (SE) | 2007-08-22 | — | — | CN | disclosed |