Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.36 |
| ▸ | TACR1 | P25103 | 10/20 | 0.33 |
| ▸ | DGAT1 | O75907 | 3/20 | 0.31 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.31 |
| ▸ | CCR2 | P41597 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4001725 | 0.83 | TACR1 (0.39) | TACR1CYP3A4S1PR1 | |
| SCHEMBL3997786 | 0.83 | KCNH2 (0.34) | TACR1KCNH2 | |
| SCHEMBL4000675 | 0.83 | TACR1 (0.33) | TACR1 | |
| SCHEMBL3995347 | 0.82 | TACR1 (0.33) | TACR1S1PR1 | |
| SCHEMBL4730021 | 0.81 | TACR1 (0.38) | TACR1 | |
| SCHEMBL4732027 | 0.81 | TACR1 (0.38) | TACR1 | |
| SCHEMBL4731956 | 0.79 | TACR1 (0.46) | TACR1CCR2KCNH2 | |
| SCHEMBL4003970 | 0.79 | TACR1 (0.36) | SMYD3TACR1CCR2 | |
| SCHEMBL4729068 | 0.78 | TACR1 (0.36) | TACR1 | |
| SCHEMBL4001632 | 0.78 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009076404-A1 | CARBOXAMIDE COMPOUNDS AND THEIR USE AS ANTAGONISTS OF THE CHEMOKINE CCR2 RECEPTOR | EPIX DELAWARE, INC. (US) | 2009-06-18 | — | — | WO | disclosed |