Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.38 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.33 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PPID | Q08752 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 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 | |
|---|---|---|---|---|
| SCHEMBL7739255 | 0.90 | ATM (0.41) | NR1H2NR1H3L3MBTL1KMT2A | |
| SCHEMBL7739221 | 0.76 | ATM (0.33) | GAAL3MBTL1KMT2A | |
| SCHEMBL7740832 | 0.75 | ATM (0.36) | L3MBTL1KMT2A | |
| SCHEMBL7738409 | 0.73 | NOS2 (0.43) | NR1H2NR1H3L3MBTL1CYP2C19KMT2A | |
| SCHEMBL7738402 | 0.73 | NOS2 (0.43) | NR1H2NR1H3L3MBTL1CYP2C19KMT2A | |
| SCHEMBL7739238 | 0.69 | SMN1; SMN2 (0.47) | HTTGAACYP2C19 | |
| SCHEMBL7740860 | 0.69 | CA2 (0.47) | NR1H2NR1H3HTTGAA | |
| SCHEMBL7740834 | 0.68 | ACE (0.53) | — | |
| SCHEMBL7737806 | 0.67 | CYP4F2 (0.56) | NR1H2NR1H3GAA | |
| SCHEMBL7740893 | 0.66 | L3MBTL1 (0.48) | NR1H2NR1H3GAAL3MBTL1KMT2A |
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 |