Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 2/20 | 0.36 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.36 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.34 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | BTK | Q06187 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | PRKCI | P41743 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | NEK2 | P51955 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | PRKCA | P17252 | 1/20 | 0.32 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.32 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7710705 | 1.00 | ELANE (0.38) | ELANEGSK3BNAPRTMKNK1MKNK2 | |
| SCHEMBL7711185 | 0.82 | CCR2 (0.37) | ELANEGSK3BMEN1LMNAPOLB | |
| SCHEMBL7704802 | 0.82 | CCR2 (0.37) | ELANEGSK3BMEN1LMNAPOLB | |
| SCHEMBL7704805 | 0.79 | HCRTR2 (0.38) | ELANEMEN1POLBKMT2A | |
| SCHEMBL12261622 | 0.78 | TNK2 (0.46) | ELANEGSK3BNAPRTSCN9ANEK2 | |
| SCHEMBL934667 | 0.78 | PDK2 (0.46) | ELANENAPRTPRKCIPDK2NOS3 | |
| SCHEMBL30469945 | 0.78 | PDK2 (0.46) | ELANENAPRTPRKCIPDK2NOS3 | |
| SCHEMBL7703480 | 0.77 | HCRTR2 (0.41) | — | |
| SCHEMBL7710548 | 0.77 | HCRTR2 (0.41) | — | |
| Potassium SCHEMBL29930626 | 0.76 | PDK2 (0.45) | ELANENAPRTPRKCIPDK2NOS3 |
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-2011131596-A1 | HETEROARYL-CYCLOHEXYL-TETRAAZABENZO[E]AZULENES AS VASOPRESSIN V1A RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2011-10-27 | — | — | WO | disclosed |