Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 2/20 | 0.33 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | PPARG | P37231 | 2/20 | 0.32 |
| ▸ | PPARD | Q03181 | 2/20 | 0.32 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | PPARA | Q07869 | 1/20 | 0.31 |
| ▸ | CPT1A | P50416 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | EBP | Q15125 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1282307 | 0.93 | S1PR4 (0.35) | DRD2S1PR4HTR1AHTR7PPARG | |
| SCHEMBL1281725 | 0.92 | S1PR4 (0.36) | DRD2S1PR4HTR1AHTR7PPARG | |
| SCHEMBL1282264 | 0.89 | S1PR4 (0.36) | S1PR4HTR1AHTR7PPARGPPARD | |
| SCHEMBL1282173 | 0.86 | ALDH1A1 (0.39) | PPARACPT1AALDH1A1CYP3A4 | |
| SCHEMBL1281563 | 0.86 | PPARA (0.36) | DRD2DRD4DRD3MEN1MAPT | |
| SCHEMBL1282118 | 0.85 | ALDH1A1 (0.40) | MEN1KMT2APPARACPT1AALDH1A1 | |
| SCHEMBL1282510 | 0.84 | HPGD (0.39) | S1PR4MEN1MAPTKMT2AALDH1A1 | |
| SCHEMBL1281978 | 0.84 | HSP90AB1 (0.32) | S1PR4MEN1KMT2AALDH1A1CYP3A4 | |
| SCHEMBL1282429 | 0.83 | HPGD (0.40) | S1PR4MEN1MAPTKMT2AALDH1A1 | |
| SCHEMBL1281730 | 0.83 | HSP90AB1 (0.32) | FFAR1MEN1KMT2AALDH1A1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2443098-A1 | ANTIFUNGAL 1, 2, 4-TRIAZOLYL DERIVATIVES | BASF SE (DE) | 2012-04-25 | — | — | EP | disclosed |
| WO-2010146112-A1 | ANTIFUNGAL 1, 2, 4-TRIAZOLYL DERIVATIVES | BASF SE (DE) | 2010-12-23 | — | — | WO | disclosed |