Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRC | P12931 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | JAK2 | O60674 | 2/20 | 0.42 |
| ▸ | JAK3 | P52333 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13769532 | 0.88 | PDE4B (0.41) | SRCNPSR1TP53MAPTKDM4E | |
| SCHEMBL4006132 | 0.86 | P2RX7 (0.43) | SRCPOLBMAPTKDM4EALDH1A1 | |
| SCHEMBL13769525 | 0.86 | MAPT (0.40) | SRCNPSR1TP53MAPTKDM4E | |
| SCHEMBL13769936 | 0.85 | PDE4B (0.42) | NPSR1TP53MAPTKDM4EALDH1A1 | |
| SCHEMBL13769676 | 0.85 | MAPT (0.39) | SRCNPSR1TP53MAPTKDM4E | |
| SCHEMBL13769926 | 0.83 | XDH (0.45) | JAK2JAK3TP53MAPTKDM4E | |
| SCHEMBL13769677 | 0.83 | MAPT (0.38) | SRCNPSR1JAK2JAK3TP53 | |
| SCHEMBL13769538 | 0.83 | MAPT (0.38) | SRCNPSR1TP53MAPTKDM4E | |
| SCHEMBL13769386 | 0.82 | MAPT (0.39) | SRCNPSR1TP53MAPTKDM4E | |
| SCHEMBL13770142 | 0.82 | JAK2 (0.48) | SRCJAK2JAK3TP53MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009080682-A1 | PYRROLO[2,3-D]PYRIMIDINE DERIVATIVES AS CGRP RECEPTOR ANTAGONISTS | GLAXO GROUP LIMITED (GB) | 2009-07-02 | — | — | WO | disclosed |