Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | APLNR | P35414 | 7/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL13255439 | 0.87 | HPGD (0.44) | NPC1APLNRRAB9AHPGDSMN1; SMN2 | |
| SCHEMBL14046413 | 0.81 | NPC1 (0.44) | NPC1APLNRRAB9AHPGDSMN1; SMN2 | |
| SCHEMBL13255384 | 0.75 | NPC1 (0.42) | NPC1APLNRRAB9AHPGDSMN1; SMN2 | |
| SCHEMBL11948563 | 0.74 | NPC1 (0.41) | NPC1APLNRRAB9AHPGDSMN1; SMN2 | |
| SCHEMBL13255425 | 0.73 | NPC1 (0.45) | NPC1APLNRRAB9AHPGDSMN1; SMN2 | |
| SCHEMBL753812 | 0.73 | NPC1 (0.46) | NPC1APLNRRAB9AHPGDSMN1; SMN2 | |
| SCHEMBL13255468 | 0.72 | NPC1 (0.45) | NPC1APLNRRAB9AHPGDSMN1; SMN2 | |
| SCHEMBL13255459 | 0.72 | NPC1 (0.45) | NPC1APLNRRAB9AHPGDSMN1; SMN2 | |
| SCHEMBL13255414 | 0.71 | NPC1 (0.48) | NPC1RAB9AHPGDSMN1; SMN2TP53 | |
| SCHEMBL13255391 | 0.71 | NPC1 (0.44) | NPC1APLNRRAB9AHPGDSMN1; SMN2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7759372-B2 | Nitrogen-containing heteroaryl compounds having inhibitory activity against HIV integrase | SHIONOGI & CO., LTD. (JP) | 2010-07-20 | — | — | US | disclosed |
| US-7759372-B2 | Nitrogen-containing heteroaryl compounds having inhibitory activity against HIV integrase | SHIONOGI & CO., LTD. (JP) | 2010-07-20 | — | — | US | disclosed |
| EP-2033952-A1 | Nitrogen-containing Heteroaryl compounds having HIV Integrase Inhibitory Activity | Shionogi&Co., Ltd. (JP) | 2009-03-11 | — | — | EP | disclosed |
| EP-1375486-B1 | NITROGEN-CONTAINING HETEROARYL COMPOUNDS HAVING HIV INTEGRASE INHIBITORY ACTIVITY | SHIONOGI & CO (JP) | 2008-10-15 | — | — | EP | disclosed |