Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.54 |
| ▸ | RAB9A | P51151 | 4/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.54 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.54 |
| ▸ | RELA | Q04206 | 2/20 | 0.54 |
| ▸ | HPGDS | O60760 | 13/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28213763 | 0.79 | NPC1 (0.58) | NPC1RAB9ASMN1; SMN2NFKB1NFKB2 | |
| Biphenyl SCHEMBL28576528 | 0.76 | CYP3A4 (0.54) | NPC1RAB9ASMN1; SMN2NFKB1NFKB2 | |
| SCHEMBL8116652 | 0.76 | CYP3A4 (0.45) | NPC1RAB9ASMN1; SMN2NFKB1NFKB2 | |
| SCHEMBL20448760 | 0.75 | NPC1 (0.58) | NPC1RAB9ASMN1; SMN2NFKB1NFKB2 | |
| SCHEMBL21993321 | 0.74 | CYP3A4 (0.52) | SMN1; SMN2MAPK1LMNAMAPT | |
| SCHEMBL139997 | 0.74 | CYP3A4 (0.52) | SMN1; SMN2MAPK1LMNAMAPT | |
| SCHEMBL1332539 | 0.73 | — | — | |
| Benzene SCHEMBL11510532 | 0.73 | MIF (0.55) | NPC1RAB9AMAPK1LMNAMAPT | |
| SCHEMBL245090 | 0.73 | MIF (0.55) | NPC1RAB9AMAPK1LMNAMAPT | |
| SCHEMBL5925 | 0.73 | — | — |
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 3 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 |
| CN-1153173-A | 1-azinyl-tetrazolinones compounds | BAYER AGROCHEM KK (JP) | 1997-07-02 | — | — | CN | disclosed |
| EP-0771797-A1 | 1-Azinyl-tetrazolinone herbicides | NIHON BAYER AGROCHEM K.K. (JP) | 1997-05-07 | — | — | EP | disclosed |