Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 1/20 | 0.44 |
| ▸ | PPARA | Q07869 | 11/20 | 0.39 |
| ▸ | PPARG | P37231 | 10/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 3/20 | 0.35 |
| ▸ | CNR2 | P34972 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11461141 | 0.94 | PPARA (0.40) | PPARAPPARGELANECYP3A4CYP1A2 | |
| SCHEMBL11537963 | 0.90 | PPARA (0.39) | PPARAPPARGCYP3A4CYP1A2CYP2D6 | |
| SCHEMBL11461445 | 0.90 | PPARA (0.40) | PPARAPPARGCYP3A4CYP1A2CYP2D6 | |
| Chlorobenzene SCHEMBL11535046 | 0.89 | PPARA (0.42) | PPARAPPARGCYP3A4CYP1A2CYP2D6 | |
| SCHEMBL11537070 | 0.87 | PPARG (0.36) | PPARAPPARGCYP3A4CYP1A2PMP22 | |
| SCHEMBL11535041 | 0.84 | MAPT (0.47) | PPARAPPARGTSHRCNR2 | |
| SCHEMBL11535121 | 0.84 | AHR (0.37) | PPARAPPARGCYP3A4CYP1A2CYP2D6 | |
| SCHEMBL11396758 | 0.83 | OPRK1 (0.47) | OPRK1PPARAPPARGELANECYP3A4 | |
| SCHEMBL11536505 | 0.83 | GAA (0.38) | OPRK1PPARAPPARGCYP3A4CYP1A2 | |
| SCHEMBL11536839 | 0.83 | ELANE (0.43) | OPRK1PPARAPPARGELANECYP3A4 |
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-4154842-A | Fungicidally and bactericidally active 1-azolyl-4-hydroxy-1-phenoxy-butane derivatives | BAYER AKTIENGESELLSCHAFT (DE) | 1979-05-15 | — | — | US | disclosed |