Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.48 |
| ▸ | DRD2 | P14416 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 1/20 | 0.48 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL884871 | 0.89 | NOTUM (0.47) | SIGMAR1DRD2DRD3NOTUMMEN1 | |
| SCHEMBL885034 | 0.80 | NOTUM (0.49) | SIGMAR1DRD2DRD3NOTUMHDAC1 | |
| SCHEMBL3111797 | 0.77 | ALK (0.37) | DRD2DRD3THRB | |
| SCHEMBL2062923 | 0.77 | ALK (0.39) | DRD2DRD3KMT2ATHRB | |
| SCHEMBL8844567 | 0.76 | SIGMAR1 (0.62) | SIGMAR1DRD2DRD3MEN1CYP1A2 | |
| SCHEMBL21894200 | 0.76 | DRD2 (0.58) | SIGMAR1DRD2DRD3THRB | |
| SCHEMBL1764370 | 0.75 | SIGMAR1 (0.61) | SIGMAR1DRD2DRD3MEN1CYP1A2 | |
| SCHEMBL1764057 | 0.75 | SIGMAR1 (0.58) | SIGMAR1DRD2DRD3NOTUMMEN1 | |
| SCHEMBL18923349 | 0.74 | POLB (0.48) | MEN1KMT2A | |
| SCHEMBL12043682 | 0.74 | NOTUM (0.46) | SIGMAR1DRD2DRD3NOTUMHTR1A |
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 |