Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 17/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL13920772 | 0.80 | CCR5 (0.61) | CCR5KCNH2 | |
| SCHEMBL4461059 | 0.76 | CCR5 (0.44) | CCR5KCNH2 | |
| SCHEMBL1220330 | 0.76 | OPRM1 (0.59) | KCNH2 | |
| SCHEMBL3817982 | 0.76 | OPRM1 (0.59) | KCNH2 | |
| SCHEMBL6703964 | 0.76 | KCNH2 (0.79) | CCR5KCNH2 | |
| SCHEMBL4474101 | 0.75 | KCNH2 (0.58) | CCR5KCNH2 | |
| SCHEMBL4466197 | 0.75 | KCNH2 (0.58) | CCR5KCNH2 | |
| Hydrochloric Acid SCHEMBL4469376 | 0.75 | OPRM1 (0.57) | KCNH2 | |
| SCHEMBL10654998 | 0.75 | LTA4H (0.64) | KCNH2 | |
| Hydrochloric Acid SCHEMBL4469375 | 0.75 | OPRM1 (0.57) | KCNH2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7507760-B2 | N-type calcium channel blockers | NEUROMED PHARMACEUTICALS LTD. (CA) | 2009-03-24 | — | — | US | disclosed |
| US-7507760-B2 | N-type calcium channel blockers | NEUROMED PHARMACEUTICALS LTD. (CA) | 2009-03-24 | — | — | US | disclosed |
| WO-2005070919-A1 | N-TYPE CALCIUM CHANNEL BLOCKERS | NEUROMED PHARMACEUTICALS LTD. (CA) | 2005-08-04 | — | — | WO | disclosed |