Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.39 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.34 |
| ▸ | NISCH | Q9Y2I1 | 2/20 | 0.33 |
| ▸ | METAP2 | P50579 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8541136 | 0.82 | CYP19A1 (0.39) | CYP19A1CYP11B1CYP11B2HCRTR1HCRTR2 | |
| SCHEMBL8540790 | 0.80 | NISCH (0.37) | CYP19A1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8539349 | 0.79 | HCRTR1 (0.40) | CYP19A1CYP11B1CYP11B2HCRTR1HCRTR2 | |
| SCHEMBL8540597 | 0.79 | CSNK1A1 (0.36) | CYP19A1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8536816 | 0.79 | JAK2 (0.47) | CYP19A1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8541400 | 0.79 | MC4R (0.37) | CYP19A1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8540730 | 0.79 | MC4R (0.46) | CYP19A1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8537087 | 0.77 | CSNK1A1 (0.45) | CYP19A1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8539649 | 0.77 | NOS3 (0.47) | CYP19A1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8535625 | 0.76 | NISCH (0.49) | CYP19A1CYP1A2CYP3A4CYP2D6CYP2C9 |
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-0857171-A2 | IMIDAZOLE DERIVATIVES AND THE USE THEREOF AS NITROGEN MONOXIDE SYNTHASE INHIBITORS | SCHERING AKTIENGESELLSCHAFT (DE) | 1998-08-12 | — | — | EP | disclosed |
| WO-1997015555-A2 | IMIDAZOLE DERIVATIVES AND THE USE THEREOF AS NITROGEN MONOXIDE SYNTHASE INHIBITORS | SCHERING AKTIENGESELLSCHAFT (DE) | 1997-05-01 | — | — | WO | disclosed |