Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 2/20 | 0.35 |
| ▸ | CNR2 | P34972 | 3/20 | 0.35 |
| ▸ | CNR1 | P21554 | 2/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 10/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 10/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL13808739 | 0.93 | RORC (0.33) | RORCHCRTR1HCRTR2DRD2DRD4 | |
| SCHEMBL13809226 | 0.81 | ABCG2 (0.39) | — | |
| SCHEMBL13808738 | 0.76 | MAPT (0.42) | DRD4 | |
| SCHEMBL13809231 | 0.74 | GRIN2C (0.39) | — | |
| SCHEMBL13748958 | 0.67 | TRPM8 (0.57) | — | |
| SCHEMBL22480510 | 0.65 | MRGPRX4 (0.65) | — | |
| SCHEMBL2783497 | 0.65 | KDM4E (0.48) | — | |
| SCHEMBL13809007 | 0.63 | GRIN2C (0.43) | LMNA | |
| SCHEMBL2233428 | 0.63 | TSHR (0.34) | — | |
| SCHEMBL13809244 | 0.62 | GRIN2C (0.36) | RORCLMNA |
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-2009073545-A2 | TETRAHYDRO-ISOQUINOLINE PPAT INHIBITORS AS ANTIBACTERIAL AGENTS | MAXTHERA, INC. (US) | 2009-06-11 | — | — | WO | disclosed |