Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | AGPAT2 | O15120 | 3/20 | 0.33 |
| ▸ | HTR2C | P28335 | 2/20 | 0.33 |
| ▸ | HTR2B | P41595 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17514739 | 0.89 | HPGD (0.36) | HPGDTSHRMAOBKMT2AHTR2C | |
| SCHEMBL17514786 | 0.88 | HPGD (0.36) | HPGDTSHRMAOBKMT2AHTR2C | |
| SCHEMBL17514656 | 0.87 | MAOB (0.36) | HPGDMAOBNPC1RAB9ALMNA | |
| SCHEMBL17514811 | 0.87 | MAOB (0.34) | HPGDTSHRMAOBCYP1A2LMNA | |
| SCHEMBL17514775 | 0.84 | HPGD (0.35) | HPGDTSHRMAOBKMT2AHTR2C | |
| SCHEMBL17514688 | 0.82 | MAOB (0.43) | HPGDTSHRMAOBKMT2ANPC1 | |
| SCHEMBL17514927 | 0.81 | MAOB (0.39) | HPGDTSHRMAOBKMT2AGSTP1 | |
| SCHEMBL17514876 | 0.80 | MAOB (0.33) | MAOBLMNAGSTP1MAPK1HSD17B10 | |
| SCHEMBL17514594 | 0.80 | KMO (0.34) | MAOBCYP1A2MAPK1HSD17B10 | |
| SCHEMBL16395362 | 0.79 | POLB (0.38) | HPGDTSHRMAOBKMT2ANPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016026830-A1 | NOVEL FUNGICIDAL PYRAZOLE DERIVATIVES | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2016-02-25 | — | — | WO | disclosed |