Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | MPO | P05164 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 3/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.34 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.33 |
| ▸ | RXRA | P19793 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | PNMT | P11086 | 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 | |
|---|---|---|---|---|
| SCHEMBL13316625 | 0.83 | MPO (0.41) | MPOP2RX7AKR1B1GRIN1GRIN2B | |
| SCHEMBL13316638 | 0.79 | MPO (0.34) | MPOAKR1B1GRIN1GRIN2BRXRA | |
| SCHEMBL13316629 | 0.75 | MPO (0.36) | MPOAKR1B1GRIN1GRIN2BSGMS2 | |
| SCHEMBL13316673 | 0.73 | PDE10A (0.39) | MPO | |
| SCHEMBL13349598 | 0.72 | CXCR2 (0.32) | MPOGRIN1GRIN2BRXRACNR2 | |
| SCHEMBL13349597 | 0.71 | CXCR2 (0.34) | MPOGRIN1GRIN2BRXRACNR2 | |
| SCHEMBL13349673 | 0.71 | MPO (0.32) | MPO | |
| SCHEMBL502199 | 0.70 | — | — | |
| SCHEMBL29622066 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL2308988 | 0.69 | CYP11B1 (0.44) | CYP11B2CYP11B1GRIN1GRIN2B |
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 |
|---|---|---|---|---|---|---|---|
| US-7745459-B2 | Quinolizinone compound and use thereof as HIV integrase inhibitor | JAPAN TOBACCO INC. (JP) | 2010-06-29 | — | — | US | disclosed |
| US-7745459-B2 | Quinolizinone compound and use thereof as HIV integrase inhibitor | JAPAN TOBACCO INC. (JP) | 2010-06-29 | — | — | US | disclosed |