Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.38 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7732418 | 0.74 | ALDH1A1 (0.38) | ALDH1A1MAPTHPGDNR1H2NR1H3 | |
| SCHEMBL7738435 | 0.69 | TAS1R3 (0.33) | ALDH1A1 | |
| SCHEMBL7738429 | 0.69 | TAS1R3 (0.33) | ALDH1A1 | |
| SCHEMBL5118101 | 0.67 | NR1H2 (0.56) | NR1H2NR1H3 | |
| SCHEMBL7739043 | 0.67 | NR1H2 (0.37) | MEN1ALDH1A1GLAMAPTHPGD | |
| SCHEMBL2229904 | 0.66 | — | — | |
| SCHEMBL8836682 | 0.65 | NR1H2 (0.63) | MAPTNR1H2NR1H3 | |
| SCHEMBL9946483 | 0.65 | — | — | |
| SCHEMBL2003493 | 0.64 | APOBEC3G (0.38) | ALDH1A1NR1H2NR1H3 | |
| SCHEMBL7740885 | 0.62 | NR1H2 (0.46) | 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 |