Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 2/20 | 0.38 |
| ▸ | AXL | P30530 | 1/20 | 0.31 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.31 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.31 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.31 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2118961 | 0.83 | FABP4 (0.37) | ELANEAXLNUDT1 | |
| SCHEMBL8752056 | 0.76 | ELANE (0.31) | ELANE | |
| SCHEMBL2355727 | 0.75 | KDM4E (0.38) | ELANEAXLNUDT1PDE3BPDE3A | |
| SCHEMBL667243 | 0.69 | JAK2 (0.33) | ELANEDYRK1AADORA2AADORA1 | |
| SCHEMBL22627323 | 0.67 | MAP2K1 (0.50) | ELANE | |
| SCHEMBL352936 | 0.67 | — | — | |
| Fluoride SCHEMBL31738503 | 0.67 | DYRK1A (0.32) | DYRK1AADORA2AADORA1 | |
| Fluoride SCHEMBL31738504 | 0.67 | DYRK1A (0.32) | DYRK1AADORA2AADORA1 | |
| SCHEMBL15496720 | 0.66 | ELANE (0.32) | ELANE | |
| SCHEMBL1833402 | 0.66 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016113205-A1 | SUBSTITUTED PENTAFLUOROETHYL PYRIMIDINONES AND USE THEREOF | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2016-07-21 | — | — | WO | disclosed |
| US-5684011-A | Pyrimidine derivatives useful as nematicides | ZENECA LIMITED (GB) | 1997-11-04 | — | — | US | disclosed |
| EP-0660827-B1 | HETEROCYCLIC COMPOUNDS WITH PARASITICAL ACTIVITY | ZENECA LTD (GB) | 1997-04-16 | — | — | EP | disclosed |
| WO-1994006777-A1 | HETEROCYCLIC COMPOUNDS WIHT PARASITICAL ACTIVITY | ZENECA LIMITED (GB) | 1994-03-31 | — | — | WO | disclosed |