Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CYP2A13 | Q16696 | 2/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | PLK4 | O00444 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.35 |
| ▸ | ABL1 | P00519 | 1/20 | 0.35 |
| ▸ | LCK | P06239 | 1/20 | 0.35 |
| ▸ | CSF1R | P07333 | 1/20 | 0.35 |
| ▸ | RET | P07949 | 1/20 | 0.35 |
| ▸ | MET | P08581 | 1/20 | 0.35 |
| ▸ | ROS1 | P08922 | 1/20 | 0.35 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
| ▸ | FER | P16591 | 1/20 | 0.35 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.35 |
| ▸ | LTK | P29376 | 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 | |
|---|---|---|---|---|
| SCHEMBL17969728 | 0.79 | ALK (0.49) | CNR2PLK4JAK2PRKD3MAP4K4 | |
| SCHEMBL20859359 | 0.77 | KDM4E (0.39) | KDM4EALDH1A1HPGDCYP2A13CNR2 | |
| SCHEMBL17918716 | 0.75 | ALK (0.46) | KDM4EALDH1A1HPGDCYP2A13CNR2 | |
| SCHEMBL16615279 | 0.74 | HDAC1 (0.33) | PLK4JAK2PRKD3MAP4K4ABL1 | |
| SCHEMBL17969742 | 0.71 | KDM4E (0.35) | KDM4EALDH1A1HPGDCYP2A13MAPT | |
| SCHEMBL16615200 | 0.71 | CHRM1 (0.45) | JAK2 | |
| SCHEMBL16615167 | 0.70 | MAP4K3 (0.31) | JAK2 | |
| SCHEMBL16615312 | 0.70 | NR1H4 (0.36) | — | |
| SCHEMBL17918740 | 0.70 | ALK (0.40) | KDM4EALDH1A1HPGDCYP2A13PLK4 | |
| SCHEMBL1601010 | 0.69 | ALK (0.67) | KDM4EALDH1A1HPGDPLK4JAK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3050884-A1 | NOVEL CHEMICAL COMPOUNDS (VARIANTS) AND THE USE THEREOF TO TREAT ONCOLOGICAL DISEASES | Limited Liability Company "National Pharmaceutical (RU) | 2016-08-03 | — | — | EP | disclosed |