Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | APLNR | P35414 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL27465167 | 0.76 | ALDH1A1 (0.41) | GABRA1GABRB2ALDH1A1CYP3A4HPGD | |
| SCHEMBL11799618 | 0.69 | GABRA1 (0.35) | GABRA1GABRB2 | |
| SCHEMBL27499839 | 0.64 | KMT2A (0.46) | ALDH1A1CYP3A4HPGDTDP1MAPT | |
| SCHEMBL3817132 | 0.64 | PDPK1 (0.45) | PDPK1ALDH1A1HPGDMAPTMEN1 | |
| SCHEMBL1021667 | 0.64 | GABRA1 (0.50) | GABRA1GABRB2ALDH1A1CYP3A4HPGD | |
| SCHEMBL6312320 | 0.63 | ALDH1A1 (0.33) | ALDH1A1CYP3A4HPGDTDP1 | |
| SCHEMBL19978863 | 0.63 | PDPK1 (0.33) | PDPK1MAPT | |
| SCHEMBL9852982 | 0.62 | PDPK1 (0.43) | PDPK1ALDH1A1HPGDMAPTMEN1 | |
| SCHEMBL28463300 | 0.62 | PDPK1 (0.43) | PDPK1ALDH1A1HPGDMAPTMEN1 | |
| SCHEMBL30559720 | 0.62 | PDPK1 (0.43) | PDPK1ALDH1A1CYP3A4HPGDMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-5776858-A | HERBICIDES | NIHON BAYER AGROCHEM K.K. (JP) | 1998-07-07 | — | — | US | disclosed |
| EP-0771797-A1 | 1-Azinyl-tetrazolinone herbicides | NIHON BAYER AGROCHEM K.K. (JP) | 1997-05-07 | — | — | EP | disclosed |