Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 10/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.38 |
| ▸ | DRD2 | P14416 | 2/20 | 0.35 |
| ▸ | DRD4 | P21917 | 2/20 | 0.35 |
| ▸ | TACR1 | P25103 | 1/20 | 0.35 |
| ▸ | SLC18A3 | Q16572 | 2/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3422811 | 1.00 | CCR2 (0.39) | CCR2KCNH2SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL8481404 | 0.85 | OPRK1 (0.42) | CCR2KCNH2SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL30899722 | 0.85 | OPRK1 (0.42) | CCR2KCNH2SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL9405511 | 0.81 | DRD2 (0.38) | CCR2KCNH2SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL9405512 | 0.81 | DRD2 (0.38) | CCR2KCNH2SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL3422161 | 0.80 | DRD2 (0.38) | CCR2KCNH2SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL5637165 | 0.80 | DRD2 (0.38) | CCR2KCNH2SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL3421132 | 0.80 | DRD2 (0.38) | CCR2KCNH2SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL23924861 | 0.74 | SLC6A3 (0.40) | SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL3655052 | 0.73 | SLC6A4 (0.41) | SLC6A3SLC6A2SLC6A4 |
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-1429811-A4 | THEURAPEUTIC TROPANE COMPOUNDS | HARVARD COLLEGE (US) | 2006-05-17 | — | — | EP | disclosed |
| EP-1429811-A1 | THEURAPEUTIC TROPANE COMPOUNDS | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2004-06-23 | — | — | EP | disclosed |
| WO-2003015830-A1 | THEURAPEUTIC TROPANE COMPOUNDS | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2003-02-27 | — | — | WO | disclosed |