Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.43 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.40 |
| ▸ | ALPL | P05186 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | INSR | P06213 | 2/20 | 0.37 |
| ▸ | MET | P08581 | 2/20 | 0.37 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2061101 | 0.80 | ATAD2 (0.59) | ALDH1A1ATAD2NPSR1INSRMET | |
| SCHEMBL2061596 | 0.80 | ATAD2 (0.56) | ALDH1A1KMT2AATAD2INSRMET | |
| SCHEMBL9591647 | 0.79 | NOTUM (0.44) | NOTUMALDH1A1MEN1KMT2ASRD5A1 | |
| SCHEMBL2061813 | 0.76 | CASP6 (0.41) | ALDH1A1KMT2AATAD2POLBINSR | |
| SCHEMBL2063017 | 0.76 | CYP1A2 (0.41) | ALDH1A1ATAD2POLBINSRMET | |
| SCHEMBL16618821 | 0.72 | CNR1 (0.54) | CNR1GPR55ALDH1A1MEN1KMT2A | |
| SCHEMBL11936216 | 0.72 | CHRM2 (0.44) | ALDH1A1MEN1KMT2AATAD2NPSR1 | |
| SCHEMBL20335482 | 0.72 | ALDH1A1 (0.47) | GPR55NOTUMALDH1A1MEN1KMT2A | |
| SCHEMBL4985948 | 0.72 | ALDH1A1 (0.41) | CNR1GPR55NOTUMALDH1A1MEN1 | |
| SCHEMBL8556193 | 0.71 | POLB (0.65) | MEN1KMT2AATAD2DRD4POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-2222647-A1 | FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND C-MET INHIBITORS | Cephalon, Inc. (US) | 2010-09-01 | — | — | EP | disclosed |
| WO-2008051547-A1 | FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND C-MET INHIBITORS | CEPHALON, INC. (US) | 2008-05-02 | — | — | WO | disclosed |