Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.62 |
| ▸ | TP53 | P04637 | 5/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.62 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | GPX4 | P36969 | 1/20 | 0.35 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10888309 | 0.83 | ALDH1A1 (0.63) | ALDH1A1TP53TDP1CYP3A4NR1I2 | |
| SCHEMBL10858355 | 0.81 | TP53 (0.74) | ALDH1A1TP53TDP1CYP3A4NR1I2 | |
| SCHEMBL10892576 | 0.81 | ALDH1A1 (0.58) | ALDH1A1TP53TDP1CYP3A4NR1I2 | |
| SCHEMBL10890129 | 0.81 | TP53 (0.58) | ALDH1A1TP53TDP1CYP3A4NR1I2 | |
| SCHEMBL16998573 | 0.79 | TP53 (0.53) | ALDH1A1TP53TDP1CYP3A4NR1I2 | |
| SCHEMBL8204724 | 0.79 | ALDH1A1 (0.71) | ALDH1A1TP53TDP1CYP3A4NR1I2 | |
| SCHEMBL11122093 | 0.79 | TP53 (0.71) | ALDH1A1TP53TDP1CYP3A4NR1I2 | |
| SCHEMBL17002042 | 0.78 | TP53 (0.55) | ALDH1A1TP53TDP1CYP3A4NR1I2 | |
| SCHEMBL27536448 | 0.78 | TP53 (0.58) | ALDH1A1TP53TDP1CYP3A4NR1I2 | |
| Acetochlor SCHEMBL9298916 | 0.77 | TP53 (0.95) | ALDH1A1TP53TDP1CYP3A4NR1I2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0013742-A1 | Substituted sulfonic acid anilides, their preparation and use | BASF Aktiengesellschaft (DE) | 1980-08-06 | — | — | EP | disclosed |