Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.31 |
| ▸ | JAK2 | O60674 | 2/20 | 0.31 |
| ▸ | JAK1 | P23458 | 2/20 | 0.31 |
| ▸ | TYK2 | P29597 | 2/20 | 0.31 |
| ▸ | JAK3 | P52333 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18323580 | 0.87 | KDM4E (0.37) | BRD4KDM4ECHRNB2CHRNB4CHRNA3 | |
| SCHEMBL18323594 | 0.83 | KDM4E (0.38) | KDM4ECHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL18323678 | 0.82 | CYP2C9 (0.35) | CHRNB2CHRNB4CHRNA3CHRNA4CYP2C9 | |
| SCHEMBL15907120 | 0.82 | MEN1 (0.35) | CHRNB2CHRNB4CHRNA3CHRNA4CYP2C9 | |
| SCHEMBL18323618 | 0.79 | KDM4E (0.55) | BRD4KDM4ELMNAKMT2ATSHR | |
| SCHEMBL18323643 | 0.77 | KDM4E (0.56) | BRD4KDM4ELMNA | |
| SCHEMBL18323639 | 0.76 | BRD4 (0.40) | BRD4KDM4ELMNAKMT2A | |
| SCHEMBL18323620 | 0.74 | BRD4 (0.39) | BRD4KDM4ELMNAKMT2ATSHR | |
| SCHEMBL18323696 | 0.74 | BRD4 (0.39) | BRD4KDM4ELMNAKMT2A | |
| SCHEMBL18323619 | 0.71 | BRD4 (0.37) | BRD4KDM4ELMNAKMT2ATSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-9522910-B2 | Protein kinase inhibitors (variants), use thereof in treating oncological diseases and a pharmaceutical composition based thereon | Obshchestvo s ogranichennoy otvetstvennostyou “Fusion Pharma” (RU) | 2016-12-20 | — | — | US | disclosed |