Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 1/20 | 0.67 |
| ▸ | TP53 | P04637 | 6/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | GPX4 | P36969 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Butachlor SCHEMBL9540687 | 0.93 | TDP1 (0.60) | NR1I2TP53ALDH1A1TDP1CYP3A4 | |
| Butachlor SCHEMBL7201694 | 0.86 | TDP1 (0.67) | NR1I2TP53ALDH1A1TDP1CYP3A4 | |
| SCHEMBL9697036 | 0.86 | NR1I2 (0.49) | NR1I2TP53ALDH1A1TDP1CYP3A4 | |
| SCHEMBL8433228 | 0.86 | TP53 (0.59) | NR1I2TP53ALDH1A1TDP1CYP3A4 | |
| Metazachlor SCHEMBL9576104 | 0.85 | TP53 (0.72) | NR1I2TP53ALDH1A1TDP1CYP3A4 | |
| SCHEMBL9214429 | 0.84 | NR1I2 (0.85) | NR1I2TP53ALDH1A1TDP1CYP3A4 | |
| Metazachlor SCHEMBL4896537 | 0.84 | TP53 (0.48) | NR1I2TP53ALDH1A1TDP1CYP3A4 | |
| Metazachlor SCHEMBL55016 | 0.84 | TP53 (0.48) | NR1I2TP53ALDH1A1TDP1CYP3A4 | |
| SCHEMBL9367287 | 0.84 | TP53 (0.56) | NR1I2TP53ALDH1A1TDP1CYP3A4 | |
| Pretilachlor SCHEMBL63720 | 0.82 | NR1I2 (1.00) | NR1I2TP53ALDH1A1TDP1CYP3A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0565593-A1 | REDUCING PESTICIDAL INTERACTIONS IN CROPS | MONSANTO COMPANY (US) | 1993-10-20 | — | — | EP | disclosed |
| EP-0562015-A1 | SAFENED HERBICIDAL SULFONAMIDE COMPOSITIONS | MONSANTO COMPANY (US) | 1993-09-29 | — | — | EP | disclosed |
| WO-1992011761-A1 | REDUCING PESTICIDAL INTERACTIONS IN CROPS | MONSANTO COMPANY (US) | 1992-07-23 | — | — | WO | disclosed |
| WO-1992002509-A1 | HERBICIDAL SUBSTITUTED ARYL ALKYLSULFONYL PYRAZOLES | MONSANTO COMPANY (US) | 1992-02-20 | — | — | WO | disclosed |