Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | PDXK | O00764 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2003493 | 0.81 | APOBEC3G (0.38) | NR1H2NR1H3MAOBPDXK | |
| SCHEMBL7737512 | 0.79 | RXFP1 (0.33) | NR1H2NR1H3LMNAL3MBTL1 | |
| SCHEMBL7732437 | 0.76 | PTPN1 (0.35) | NR1H2NR1H3MAOBKDM4ENPC1 | |
| SCHEMBL1976914 | 0.70 | GCGR (0.39) | MAOBKDM4ENPC1LMNAGAA | |
| SCHEMBL431656 | 0.70 | CYP2A6 (0.48) | MAOBKDM4ENPC1LMNAGAA | |
| SCHEMBL29602459 | 0.70 | CYP2A6 (0.48) | MAOBKDM4ENPC1LMNAGAA | |
| SCHEMBL10941267 | 0.68 | NR1H2 (0.38) | NR1H2NR1H3NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL10913604 | 0.68 | ALDH1A1 (0.39) | NR1H2NR1H3 | |
| Vinyl Ether SCHEMBL17063067 | 0.67 | CYP2A6 (0.36) | MAOBKDM4ENPC1LMNAGAA | |
| SCHEMBL18796002 | 0.67 | NR1H2 (0.37) | NR1H2NR1H3 |
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-6416861-B1 | COMBINATORIAL CHEMISTRY | NORTHWESTERN UNIVERSITY | 2002-07-09 | — | — | US | disclosed |
| WO-2000049022-A2 | ORGANOSILICON COMPOUNDS AND USES THEREOF | NORTHWESTERN UNIVERSITY (US) | 2000-08-24 | — | — | WO | disclosed |