Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.44 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 4/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | CA7 | P43166 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9868685 | 0.77 | BRD4 (0.46) | NR1H2NR1H3CYP3A4HPGDSMN1; SMN2 | |
| SCHEMBL10650298 | 0.76 | POLB (0.39) | CYP3A4HPGDTDP1ALDH1A1KDM4E | |
| SCHEMBL9869213 | 0.74 | CA12 (0.46) | HPGDALDH1A1CYP1A2KDM4EGAA | |
| SCHEMBL9315811 | 0.72 | ALOX15 (0.45) | HPGDSMN1; SMN2ALDH1A1CYP1A2KDM4E | |
| SCHEMBL9869982 | 0.70 | ADORA3 (0.42) | NR1H2NR1H3CYP3A4HPGDALDH1A1 | |
| SCHEMBL9869186 | 0.70 | CA12 (0.42) | NR1H2NR1H3HPGDALDH1A1CYP1A2 | |
| SCHEMBL20135722 | 0.69 | CA12 (0.45) | NR1H2NR1H3CYP3A4HPGDSMN1; SMN2 | |
| SCHEMBL17730283 | 0.69 | GABRA1 (0.37) | HPGDSMN1; SMN2ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL19438029 | 0.69 | SMN1; SMN2 (0.38) | NR1H2NR1H3HPGDSMN1; SMN2ALDH1A1 | |
| SCHEMBL9868508 | 0.69 | GABRA1 (0.49) | NR1H2NR1H3CYP3A4HPGDSMN1; SMN2 |
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-4997947-A | Forming 6-substituted pyridine-2,3-dicarboxylic esters followed by reacting with aminoalkanecarboxylic acid amide; herbicides, plant growth regulators | CIBA-GEIGY CORPORATION (US) | 1991-03-05 | — | — | US | disclosed |