Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.55 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.55 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | TBXAS1 | P24557 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.44 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7591853 | 0.85 | NAPRT (0.67) | NAPRTCYP1A2CYP3A4CYP2C9CYP19A1 | |
| SCHEMBL27854109 | 0.82 | NAPRT (0.62) | NAPRTCYP1A2CYP3A4CYP2C9CYP19A1 | |
| SCHEMBL29466814 | 0.82 | NAPRT (0.62) | NAPRTCYP1A2CYP3A4CYP2C9CYP19A1 | |
| SCHEMBL26116265 | 0.82 | NAPRT (0.62) | NAPRTCYP1A2CYP3A4CYP2C9CYP19A1 | |
| SCHEMBL178130 | 0.82 | NAPRT (0.62) | NAPRTCYP1A2CYP3A4CYP2C9CYP19A1 | |
| Ammonia Solution, Strong SCHEMBL27841922 | 0.81 | NAPRT (0.61) | NAPRTCYP1A2CYP3A4CYP2C9CYP19A1 | |
| SCHEMBL29262861 | 0.80 | NAPRT (0.56) | NAPRTCYP1A2CYP3A4CYP2C9CYP19A1 | |
| SCHEMBL7326169 | 0.79 | NAPRT (0.69) | NAPRTCYP1A2CYP3A4CYP2C9CYP19A1 | |
| SCHEMBL30225124 | 0.79 | NAPRT (0.59) | NAPRTCYP1A2CYP3A4CYP2C9CYP19A1 | |
| SCHEMBL701469 | 0.79 | NAPRT (0.59) | NAPRTCYP1A2CYP3A4CYP2C9CYP19A1 |
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-1329160-A2 | 4-ACYLAMINOPYRAZOLE DERIVATIVES | Sankyo Company, Limited (JP) | 2003-07-23 | — | — | EP | claimed |
| EP-1329160-A2 | 4-ACYLAMINOPYRAZOLE DERIVATIVES | Sankyo Company, Limited (JP) | 2003-07-23 | — | — | EP | disclosed |
| US-3965099-A | Cephalosporin esters with antibacterial activity | SMITHKLINE CORPORATION (US) | 1976-06-22 | — | — | US | disclosed |