Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | NMUR2 | Q9GZQ4 | 2/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 4/20 | 0.40 |
| ▸ | GABRA3 | P34903 | 4/20 | 0.40 |
| ▸ | GABRA2 | P47869 | 4/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.40 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.40 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.40 |
| ▸ | BRD4 | O60885 | 3/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
| ▸ | ACLY | P53396 | 1/20 | 0.35 |
| ▸ | PTPRC | P08575 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | GABRP | O00591 | 1/20 | 0.34 |
| ▸ | GABRD | O14764 | 1/20 | 0.34 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11550813 | 0.82 | BRD4 (0.41) | BRD4PTPRCMAPK1ALDH1A1SMN1; SMN2 | |
| SCHEMBL11554573 | 0.82 | ALDH1A1 (0.48) | GABRA1GABRA5GABRA3GABRA2GABRB2 | |
| SCHEMBL11178194 | 0.81 | BRD4 (0.40) | GABRA1GABRA5GABRA3GABRA2GABRB2 | |
| SCHEMBL11441314 | 0.78 | BRD4 (0.52) | BRD4CYP2C19ALDH1A1SMN1; SMN2 | |
| SCHEMBL11428886 | 0.78 | ALDH1A1 (0.36) | BRD4MAPK1ALDH1A1 | |
| SCHEMBL28462601 | 0.77 | MAPK1 (0.46) | NMUR2GABRA1GABRA5GABRA3GABRA2 | |
| SCHEMBL11426220 | 0.76 | BRD4 (0.44) | BRD4CYP2C9CYP1A2ALDH1A1 | |
| SCHEMBL11436078 | 0.76 | MAOB (0.42) | POLBMAPK1ALDH1A1SMN1; SMN2 | |
| SCHEMBL11554969 | 0.76 | BRD4 (0.43) | BRD4 | |
| SCHEMBL11547644 | 0.75 | BRD4 (0.48) | BRD4ALDH1A1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4235619-A | USING 3-PHENYL-4(1H)-PYRIDONES OR PYRIDINETHIONES | ELI LILLY AND COMPANY (US) | 1980-11-25 | — | — | US | disclosed |
| US-4152136-A | HERBICIDES | ELI LILLY AND COMPANY (US) | 1979-05-01 | — | — | US | disclosed |