Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 1/20 | 0.47 |
| ▸ | BRAF | P15056 | 2/20 | 0.41 |
| ▸ | PDE4A | P27815 | 2/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.41 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.41 |
| ▸ | EEF2K | O00418 | 1/20 | 0.41 |
| ▸ | PLAU | P00749 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.39 |
| ▸ | JAK2 | O60674 | 5/20 | 0.39 |
| ▸ | JAK3 | P52333 | 5/20 | 0.39 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.37 |
| ▸ | SYK | P43405 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3407889 | 0.88 | IKBKB (0.51) | IKBKBEEF2KPLAUKCNH2SCN5A | |
| SCHEMBL3411850 | 0.88 | IKBKB (0.48) | IKBKBBRAFPDE4APDE4BPDE4C | |
| SCHEMBL3411616 | 0.85 | IKBKB (0.40) | IKBKBBRAFPDE4APDE4BPDE4C | |
| SCHEMBL1176457 | 0.85 | IKBKB (0.65) | IKBKBBRAFPDE4APDE4BPDE4C | |
| SCHEMBL3408796 | 0.82 | IKBKB (0.43) | IKBKBBRAFPDE4APDE4BPDE4C | |
| SCHEMBL3406840 | 0.82 | LIMK1 (0.42) | BRAFPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL3414021 | 0.81 | IKBKB (0.42) | IKBKBEEF2KPLAUKCNH2SCN5A | |
| SCHEMBL3414237 | 0.80 | IKBKB (0.41) | IKBKBBRAFPDE4APDE4BPDE4C | |
| SCHEMBL3411690 | 0.76 | MAPT (0.41) | BRAFPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL3657555 | 0.75 | EEF2K (0.46) | IKBKBBRAFEEF2KPLAUKCNH2 |
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-2260044-A2 | THIENOPYRIMIDINES | Merck Patent GmbH (DE) | 2010-12-15 | — | — | EP | disclosed |
| WO-2009124653-A2 | THIENOPYRIMIDINES | MERCK PATENT GMBH (DE) | 2009-10-15 | — | — | WO | disclosed |