Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 16/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | UGCG | Q16739 | 2/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.45 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL12398377 | 0.88 | CCR1 (0.74) | CCR1KCNH2 | |
| SCHEMBL2160124 | 0.88 | CCR1 (0.74) | CCR1KCNH2 | |
| SCHEMBL3941668 | 0.86 | CCR1 (0.78) | CCR1ACE2KCNH2 | |
| SCHEMBL10291673 | 0.78 | CCR1 (0.45) | CCR1CYP3A4UGCGEPHX2 | |
| SCHEMBL3945220 | 0.78 | CCR1 (0.78) | CCR1ACE2 | |
| SCHEMBL3946317 | 0.78 | CCR1 (0.78) | CCR1ACE2 | |
| SCHEMBL3007113 | 0.76 | CCR1 (1.00) | CCR1 | |
| SCHEMBL3943809 | 0.76 | CCR1 (1.00) | CCR1 | |
| SCHEMBL3007118 | 0.76 | CCR1 (1.00) | CCR1 | |
| SCHEMBL3940996 | 0.76 | CCR1 (0.67) | CCR1KCNH2 |
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-2049486-A2 | PIPERIDINYL DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | Bristol-Myers Squibb Company (US) | 2009-04-22 | — | — | EP | disclosed |
| WO-2007092681-A2 | PIPERIDINYL DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-08-16 | — | — | WO | disclosed |