Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.42 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.42 |
| ▸ | IKBKB | O14920 | 1/20 | 0.41 |
| ▸ | CHUK | O15111 | 1/20 | 0.41 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 1/20 | 0.40 |
| ▸ | DHX9 | Q08211 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10332567 | 1.00 | ALDH1A1 (0.53) | ALDH1A1SMN1; SMN2POLBKEAP1HPGD | |
| SCHEMBL8120763 | 0.87 | HPGD (0.41) | ALDH1A1SMN1; SMN2HPGDCA2ADRA1A | |
| SCHEMBL11466281 | 0.86 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2POLBKEAP1HPGD | |
| SCHEMBL8867750 | 0.86 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2POLBKEAP1HPGD | |
| SCHEMBL8867745 | 0.86 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2POLBKEAP1HPGD | |
| SCHEMBL11653449 | 0.84 | POLB (0.56) | ALDH1A1SMN1; SMN2POLBKEAP1HPGD | |
| SCHEMBL4370199 | 0.79 | KEAP1 (0.52) | ALDH1A1SMN1; SMN2POLBKEAP1HSD17B1 | |
| SCHEMBL28012269 | 0.76 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2POLBKEAP1HPGD | |
| SCHEMBL245468 | 0.76 | MEN1 (0.60) | ALDH1A1SMN1; SMN2POLBKEAP1HSD17B1 | |
| SCHEMBL10100499 | 0.75 | KEAP1 (0.55) | ALDH1A1SMN1; SMN2POLBKEAP1HSD17B1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0187500-B1 | MONOBACTAMS | THE UPJOHN COMPANY (US) | 1993-04-28 | — | — | EP | disclosed |
| EP-0187500-A1 | Monobactams | THE UPJOHN COMPANY (US) | 1986-07-16 | — | — | EP | disclosed |