Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
| ▸ | OGFRL1 | Q5TC84 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MTOR | P42345 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL12778062 | 0.94 | L3MBTL1 (0.39) | KDM4EALDH1A1L3MBTL1RXFP1MAPT | |
| SCHEMBL2080371 | 0.89 | ALDH1A1 (0.32) | KDM4EALDH1A1L3MBTL1MAPTNPC1 | |
| SCHEMBL1170023 | 0.88 | L3MBTL1 (0.35) | KDM4EALDH1A1L3MBTL1RXFP1MAPT | |
| SCHEMBL1169799 | 0.88 | L3MBTL1 (0.35) | KDM4EALDH1A1L3MBTL1MAPTNPC1 | |
| SCHEMBL12864848 | 0.88 | L3MBTL1 (0.35) | KDM4EALDH1A1L3MBTL1RXFP1MAPT | |
| SCHEMBL1169659 | 0.85 | KDM4E (0.36) | KDM4EALDH1A1L3MBTL1RXFP1MAPT | |
| SCHEMBL12777960 | 0.85 | KDM4E (0.36) | KDM4EALDH1A1L3MBTL1RXFP1MAPT | |
| SCHEMBL13647700 | 0.83 | KDM4E (0.33) | KDM4EALDH1A1L3MBTL1MAPTNPC1 | |
| SCHEMBL2083133 | 0.82 | ALDH1A1 (0.33) | KDM4EALDH1A1L3MBTL1MAPTNPC1 | |
| SCHEMBL5531972 | 0.81 | MEN1 (0.41) | KDM4EALDH1A1L3MBTL1MAPTNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7419969-B2 | HIV integrase inhibitors: cyclic pyrimidinone compounds | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-09-02 | — | — | US | disclosed |
| US-7419969-B2 | HIV integrase inhibitors: cyclic pyrimidinone compounds | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-09-02 | — | — | US | disclosed |
| WO-2007058646-A1 | HIV INTEGRASE INHIBITORS: CYCLIC PYRIMIDINONE COMPOUNDS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-05-24 | — | — | WO | disclosed |