Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.36 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.36 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.36 |
| ▸ | LARS1 | Q9P2J5 | 1/20 | 0.36 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KYNU | Q16719 | 2/20 | 0.36 |
| ▸ | MMP1 | P03956 | 2/20 | 0.35 |
| ▸ | MMP2 | P08253 | 2/20 | 0.35 |
| ▸ | MMP13 | P45452 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL6649064 | 0.75 | HSD11B1 (0.46) | HSD11B1CYP1A2CYP2D6ALDH1A1NPC1 | |
| SCHEMBL1464395 | 0.71 | HSD11B1 (0.48) | HSD11B1ALDH1A1NPC1RECQLRAB9A | |
| SCHEMBL382489 | 0.71 | SLC1A2 (0.40) | HSD11B1CYP1A2CYP2D6ALDH1A1SLC1A3 | |
| SCHEMBL28442855 | 0.70 | CA1 (0.48) | HSD11B1ALDH1A1PSIP1MMP1MMP2 | |
| SCHEMBL28797596 | 0.70 | MAPT (0.47) | HSD11B1ALDH1A1NPC1RECQLRAB9A | |
| SCHEMBL10604801 | 0.70 | HSD11B1 (0.47) | HSD11B1CYP1A2CYP2D6ALDH1A1NPC1 | |
| SCHEMBL27182773 | 0.69 | HSD11B1 (0.43) | HSD11B1CYP1A2CYP2D6ALDH1A1NPC1 | |
| SCHEMBL27388235 | 0.69 | HSD11B1 (0.43) | HSD11B1CYP1A2CYP2D6ALDH1A1NPC1 | |
| SCHEMBL5175906 | 0.69 | ALDH1A1 (0.45) | CYP1A2CYP2D6ALDH1A1RECQLSLC1A3 | |
| SCHEMBL9188767 | 0.69 | ALDH1A1 (0.41) | ALDH1A1RECQLRAB9ASLC1A3SLC1A2 |
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-1074543-B1 | AMINOPIPERIDINE DERIVATIVES AS INTEGRIN ALPHA V BETA 3 ANTAGONISTS | MEIJI SEIKA PHARMA CO LTD (JP) | 2012-01-25 | — | — | EP | disclosed |