Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.48 |
| ▸ | USP2 | O75604 | 3/20 | 0.46 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.46 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.46 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.46 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.46 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.46 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.46 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.46 |
| ▸ | TEAD1 | P28347 | 2/20 | 0.44 |
| ▸ | TACR1 | P25103 | 6/20 | 0.44 |
| ▸ | TACR2 | P21452 | 3/20 | 0.44 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | RHOC | P08134 | 1/20 | 0.43 |
| ▸ | RHOA | P61586 | 1/20 | 0.43 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.42 |
| ▸ | CCR2 | P41597 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2817216 | 1.00 | SIGMAR1 (0.48) | SIGMAR1USP2PRKAB2PRKAG1PRKAA2 | |
| SCHEMBL2819358 | 0.89 | TACR1 (0.51) | USP2TEAD1TACR1BCHEACHE | |
| SCHEMBL2818101 | 0.87 | CHRM4 (0.52) | SIGMAR1USP2TEAD1 | |
| SCHEMBL3638063 | 0.87 | CHRM4 (0.52) | SIGMAR1USP2TEAD1 | |
| SCHEMBL2818384 | 0.85 | BCHE (0.48) | SIGMAR1TEAD1TACR1TACR2BCHE | |
| SCHEMBL2818348 | 0.85 | CHRM4 (0.44) | USP2TEAD1TACR1BCHECYP3A4 | |
| SCHEMBL2820849 | 0.85 | CHRM4 (0.47) | TEAD1TACR1BCHEACHEBACE1 | |
| SCHEMBL2824751 | 0.83 | CCR2 (0.49) | SIGMAR1TEAD1TACR1BCHEACHE | |
| SCHEMBL2817332 | 0.79 | CHRM4 (0.53) | SIGMAR1USP2 | |
| SCHEMBL2819008 | 0.77 | CHRM4 (0.48) | TACR1CCR2 |
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-2155672-A1 | PROLINAMIDE DERIVATIVES AS NK3 ANTAGONISTS | F. Hoffmann-Roche AG (CH) | 2010-02-24 | — | — | EP | disclosed |
| WO-2008148689-A1 | PROLINAMIDE DERIVATIVES AS NK3 ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2008-12-11 | — | — | WO | disclosed |