Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 13/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.38 |
| ▸ | CETP | P11597 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6620267 | 0.94 | UBE2M (0.36) | TACR1SLC6A2SLC6A4CETP | |
| SCHEMBL5215277 | 0.84 | TACR1 (0.40) | TACR1 | |
| SCHEMBL6621794 | 0.82 | TACR1 (0.49) | TACR1 | |
| SCHEMBL5212179 | 0.72 | TACR1 (0.37) | TACR1 | |
| SCHEMBL5729938 | 0.70 | CCR2 (0.49) | TACR1 | |
| SCHEMBL6957247 | 0.68 | HTT (0.47) | TACR1 | |
| SCHEMBL3287967 | 0.67 | ALDH1A1 (0.44) | — | |
| SCHEMBL14169881 | 0.66 | CCR2 (0.40) | TACR1CETP | |
| SCHEMBL6056589 | 0.66 | PTGDR2 (0.44) | — | |
| SCHEMBL6965223 | 0.62 | HTT (0.51) | TACR1SLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1318811-A4 | CYCLOPENTYL MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | MERCK & CO INC (US) | 2004-07-14 | — | — | EP | disclosed |
| EP-1318811-A1 | CYCLOPENTYL MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | Merck & Co., Inc. (US) | 2003-06-18 | — | — | EP | disclosed |
| WO-2002013824-A1 | CYCLOPENTYL MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | MERCK & CO., INC. (US) | 2002-02-21 | — | — | WO | disclosed |