Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 2/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | ELANE | P08246 | 2/20 | 0.35 |
| ▸ | CCRL2 | O00421 | 1/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 8/20 | 0.33 |
| ▸ | GSK3B | P49841 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.31 |
| ▸ | TRPV1 | Q8NER1 | 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 | |
|---|---|---|---|---|
| SCHEMBL7711185 | 1.00 | CCR2 (0.37) | CCR2KCNH2ELANECCRL2OPRL1 | |
| SCHEMBL7713005 | 0.82 | ELANE (0.38) | ELANEGSK3BMEN1LMNAPOLB | |
| SCHEMBL7710705 | 0.82 | ELANE (0.38) | ELANEGSK3BMEN1LMNAPOLB | |
| SCHEMBL7704805 | 0.79 | HCRTR2 (0.38) | ELANEMEN1POLBKMT2A | |
| SCHEMBL23362965 | 0.78 | OPRL1 (0.38) | CCR2KCNH2CCRL2OPRL1MEN1 | |
| SCHEMBL31703523 | 0.78 | OPRL1 (0.38) | CCR2KCNH2CCRL2OPRL1MEN1 | |
| SCHEMBL7710548 | 0.77 | HCRTR2 (0.41) | — | |
| SCHEMBL7703480 | 0.77 | HCRTR2 (0.41) | — | |
| SCHEMBL16803157 | 0.75 | ABL1 (0.44) | CCR2KCNH2ELANECCRL2OPRL1 | |
| SCHEMBL2564598 | 0.75 | CYP2C19 (0.49) | ELANEMEN1POLBKMT2A |
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 |