Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 3/20 | 0.36 |
| ▸ | PPARA | Q07869 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.35 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8895942 | 0.90 | ALDH1A1 (0.39) | CYP1A2CYP3A4TSHRALDH1A1CYP2D6 | |
| SCHEMBL8894580 | 0.89 | HCAR2 (0.40) | CYP1A2CYP3A4TSHRALDH1A1HCAR2 | |
| SCHEMBL8895124 | 0.84 | HCAR2 (0.41) | HCAR2AOC3PPARGPPARAMAPT | |
| SCHEMBL3171202 | 0.83 | THRB (0.40) | HCAR2CYP2C19AOC3PPARGPPARA | |
| SCHEMBL9419971 | 0.82 | HCAR2 (0.60) | CYP3A4TSHRALDH1A1HCAR2CYP2C19 | |
| SCHEMBL9420058 | 0.82 | HCAR2 (0.60) | CYP3A4TSHRALDH1A1HCAR2CYP2C19 | |
| SCHEMBL9419967 | 0.82 | HCAR2 (0.60) | CYP3A4TSHRALDH1A1HCAR2CYP2C19 | |
| SCHEMBL8894006 | 0.81 | HCAR2 (0.59) | CYP1A2CYP3A4TSHRALDH1A1HCAR2 | |
| SCHEMBL1841218 | 0.80 | AOC3 (0.42) | AOC3PPARGPPARAKMT2AGPR88 | |
| SCHEMBL982155 | 0.80 | MTNR1A (0.43) | AOC3PPARGPPARAKMT2AGPR88 |
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-5670563-A | ORGANOTIN COMPOUND, PHOSPHORUS COMPOUND | CIBA-SPECIALTY CHEMICALS CORPORATION (US) | 1997-09-23 | — | — | US | disclosed |