Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 5/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | HPSE | Q9Y251 | 1/20 | 0.43 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 2/20 | 0.42 |
| ▸ | TTR | P02766 | 1/20 | 0.42 |
| ▸ | ALB | P02768 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | DRD1 | P21728 | 1/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.42 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.42 |
| ▸ | KMO | O15229 | 2/20 | 0.42 |
| ▸ | DDT | P30046 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2109256 | 0.85 | ERN1 (0.53) | ERN1KDM4EALDH1A1NPC1RAB9A | |
| SCHEMBL7302599 | 0.83 | TOP2A (0.47) | L3MBTL1KDM4EALDH1A1POLBTDP1 | |
| SCHEMBL1675377 | 0.77 | TTR (0.68) | L3MBTL1KDM4EALDH1A1NPC1RAB9A | |
| SCHEMBL1675466 | 0.77 | HPSE (0.64) | KDM4EALDH1A1POLBNPC1RAB9A | |
| SCHEMBL15372571 | 0.75 | HPSE (0.50) | L3MBTL1KDM4EALDH1A1POLBNPC1 | |
| SCHEMBL4583536 | 0.74 | HTR3A (0.44) | KDM4EALDH1A1MAOASMN1; SMN2TOP2A | |
| SCHEMBL1675525 | 0.74 | HDAC6 (0.63) | KDM4EALDH1A1POLBNPC1RAB9A | |
| SCHEMBL1675639 | 0.74 | TTR (0.56) | L3MBTL1ALDH1A1NPC1RAB9AHPSE | |
| SCHEMBL219613 | 0.74 | SMN1; SMN2 (0.69) | L3MBTL1KDM4EALDH1A1POLBNPC1 | |
| SCHEMBL1675479 | 0.73 | NPC1 (0.64) | KDM4EALDH1A1POLBTDP1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1713799-A2 | COMPOUNDS AND COMPOSITIONS AS LXR MODULATORS | IRM, LLC (BM) | 2006-10-25 | — | — | EP | disclosed |
| WO-2005077124-A2 | COMPOUNDS AND COMPOSITIONS AS LXR MODULATORS | IRM LLC (BM) | 2005-08-25 | — | — | WO | disclosed |