Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.40 |
| ▸ | TP53 | P04637 | 6/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 6/20 | 0.38 |
| ▸ | NPC1 | O15118 | 5/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | PAX8 | Q06710 | 4/20 | 0.33 |
| ▸ | JAK2 | O60674 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | GPX4 | P36969 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL9215840 | 0.88 | ALDH1A1 (0.50) | NR1I2ALDH1A1TP53TDP1CYP3A4 | |
| SCHEMBL9209097 | 0.85 | NR1I2 (0.46) | NR1I2ALDH1A1TP53TDP1CYP3A4 | |
| SCHEMBL9214286 | 0.83 | NR1I2 (0.54) | NR1I2ALDH1A1TP53TDP1CYP3A4 | |
| SCHEMBL9207005 | 0.82 | TP53 (0.64) | NR1I2ALDH1A1TP53TDP1CYP3A4 | |
| SCHEMBL10622812 | 0.82 | ALDH1A1 (0.45) | NR1I2ALDH1A1TP53TDP1CYP3A4 | |
| SCHEMBL11876794 | 0.78 | ALDH1A1 (0.46) | NR1I2ALDH1A1TP53TDP1CYP3A4 | |
| SCHEMBL27564754 | 0.75 | TP53 (0.61) | NR1I2ALDH1A1TP53TDP1CYP3A4 | |
| SCHEMBL9614221 | 0.73 | ALDH1A1 (0.59) | NR1I2ALDH1A1TP53TDP1CYP3A4 | |
| SCHEMBL9319865 | 0.73 | RAB9A (0.41) | NR1I2ALDH1A1TP53RAB9ANPC1 | |
| SCHEMBL9319803 | 0.73 | NPC1 (0.44) | NR1I2ALDH1A1TP53RAB9ANPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4070179-A | Plant growth regulation with N-(2-alkoxy-ethyl)-N-chloroacetyl-2,3,6-trimethyl-anilines | CIBA-GEIGY CORPORATION (US) | 1978-01-24 | — | — | US | disclosed |