Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | LIG1 | P18858 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 2/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1223272 | 0.86 | CYP3A4 (0.46) | CYP3A4KDM4EALDH1A1TSHRHSD17B10 | |
| SCHEMBL61520 | 0.82 | TSHR (0.55) | KDM4EALDH1A1TSHRHSD17B10MAPT | |
| SCHEMBL30242196 | 0.82 | CYP3A4 (0.47) | CYP3A4ALDH1A1TSHRHSD17B10NPC1 | |
| SCHEMBL2043425 | 0.82 | CYP3A4 (0.43) | CYP3A4KDM4EALDH1A1TSHRHSD17B10 | |
| SCHEMBL23404252 | 0.82 | CYP3A4 (0.47) | CYP3A4ALDH1A1TSHRHSD17B10NPC1 | |
| SCHEMBL6199923 | 0.82 | LMNA (0.48) | CYP3A4ALDH1A1TSHRNPC1CTNNB1 | |
| SCHEMBL1899108 | 0.79 | HSD17B10 (0.58) | CYP3A4KDM4EALDH1A1TSHRHSD17B10 | |
| SCHEMBL29030397 | 0.79 | CYP3A4 (0.53) | CYP3A4ALDH1A1TSHRHSD17B10NPC1 | |
| SCHEMBL8840180 | 0.79 | CYP3A4 (0.41) | CYP3A4KDM4EALDH1A1TSHRHSD17B10 | |
| SCHEMBL2536413 | 0.79 | AKT1 (0.50) | CYP3A4KDM4EALDH1A1TSHRHSD17B10 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4873177-A | RINSING WITH A MIXTURE OF AQUEOUS QUATERNARY AMMONIUM HYDROXIDE AND WATER MISCIBLE ORGANIC SOLVENT | TOKYO OHKA KOGYO CO., LTD. (JP) | 1989-10-10 | — | — | US | disclosed |