Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | HPGD | P15428 | 4/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | GLA | P06280 | 1/20 | 0.30 |
| ▸ | CASP1 | P29466 | 1/20 | 0.30 |
| ▸ | CASP7 | P55210 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.30 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20550992 | 0.74 | FBP1 (0.36) | KDM4EALDH1A1HPGDMAPTHSD17B10 | |
| SCHEMBL29249788 | 0.74 | KDM4E (0.36) | KDM4EALDH1A1HPGDMAPTMEN1 | |
| SCHEMBL6944627 | 0.74 | GSK3B (0.35) | KDM4EALDH1A1HPGDMAPTHSD17B10 | |
| SCHEMBL2341397 | 0.69 | — | — | |
| SCHEMBL2290788 | 0.69 | FBP1 (0.36) | KDM4EALDH1A1HPGDMAPTHSD17B10 | |
| SCHEMBL30272164 | 0.69 | SMN1; SMN2 (0.33) | KDM4EALDH1A1HPGDMAPTHSD17B10 | |
| SCHEMBL29249843 | 0.69 | SMN1; SMN2 (0.33) | KDM4EALDH1A1HPGDMAPTHSD17B10 | |
| SCHEMBL19600567 | 0.68 | TAAR1 (0.47) | TSHRTAAR1 | |
| SCHEMBL8836682 | 0.68 | NR1H2 (0.63) | NR1H2NR1H3MAPT | |
| SCHEMBL1147728 | 0.67 | NR1H2 (0.53) | NR1H2NR1H3ALDH1A1MAPTMEN1 |
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 |