Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | CCR1 | P32246 | 3/20 | 0.52 |
| ▸ | CCR5 | P51681 | 3/20 | 0.52 |
| ▸ | CCR8 | P51685 | 3/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | TP53 | P04637 | 2/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | ALPL | P05186 | 1/20 | 0.52 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.52 |
| ▸ | ALPI | P09923 | 1/20 | 0.52 |
| ▸ | ALPG | P10696 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | METAP1 | P53582 | 1/20 | 0.48 |
| ▸ | BLM | P54132 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL5361055 | 0.83 | KDM4E (0.52) | KDM4ELMNACCR1CCR5CCR8 | |
| SCHEMBL27764279 | 0.81 | IKBKB (0.55) | HSP90AA1RAB9ACA9CA2CA12 | |
| Dipyridyl SCHEMBL27645628 | 0.75 | KDM4E (0.64) | KDM4ELMNACCR1CCR5CCR8 | |
| Dipyridyl SCHEMBL28775778 | 0.74 | CA9 (0.64) | KDM4ELMNACCR1CCR5CCR8 | |
| SCHEMBL1181563 | 0.74 | KDM4E (0.88) | KDM4ELMNACCR1CCR5CCR8 | |
| SCHEMBL3036765 | 0.72 | KDM4E (0.82) | KDM4ELMNACCR1CCR5CCR8 | |
| SCHEMBL51141 | 0.72 | CA1 (0.43) | KDM4ELMNATDP1HSP90AA1MAPK1 | |
| SCHEMBL460135 | 0.72 | HSP90AA1 (0.62) | KDM4ELMNACCR1CCR5CCR8 | |
| SCHEMBL29462395 | 0.72 | HSP90AA1 (0.62) | KDM4ELMNACCR1CCR5CCR8 | |
| SCHEMBL776048 | 0.71 | KDM4E (0.67) | KDM4ELMNACCR1CCR5CCR8 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101068805-B | Novel phenylaminopyrimidine derivatives as inhibitors of BCR-ABL kinase | NATCO PHARMA LTD | 2013-04-03 | — | — | CN | disclosed |
| CN-101068805-A | Novel phenylaminopyrimidine derivatives as inhibitors of BCR-ABL kinase | NATCO PHARMA LTD (IN) | 2007-11-07 | — | — | CN | disclosed |