Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.53 |
| ▸ | IDO1 | P14902 | 13/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | GRM5 | P41594 | 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 | |
|---|---|---|---|---|
| SCHEMBL2801582 | 0.83 | P2RX7 (0.53) | P2RX7GRM5 | |
| SCHEMBL5240146 | 0.78 | RAB9A (0.57) | P2RX7GRM5 | |
| SCHEMBL18230341 | 0.77 | HTT (0.62) | NAPRTIDO1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL5198154 | 0.77 | P2RX7 (0.46) | CYP1A2P2RX7GRM5 | |
| SCHEMBL5235569 | 0.76 | P2RX7 (0.49) | P2RX7GRM5 | |
| SCHEMBL4030946 | 0.74 | HDAC3 (0.49) | P2RX7 | |
| SCHEMBL6283045 | 0.74 | IDO1 (0.58) | NAPRTIDO1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL5240771 | 0.73 | USP2 (0.51) | CYP3A4P2RX7 | |
| SCHEMBL5235128 | 0.73 | ALOX5 (0.49) | CYP1A2P2RX7CYP2A6GRM5 | |
| SCHEMBL3281175 | 0.73 | VNN1 (0.58) | NAPRTIDO1CYP1A2CYP3A4CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1397364-B1 | NOVEL PYRROLE DERIVATIVES AS PHARMACEUTICAL AGENTS | LILLY CO ELI (US) | 2007-07-25 | — | — | EP | disclosed |