Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 2/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | ELANE | P08246 | 1/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.38 |
| ▸ | DPP4 | P27487 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1768210 | 0.91 | HSD11B1 (0.46) | HSD11B1CYP2A6ALDH1A1MAPK1LMNA | |
| SCHEMBL20961408 | 0.84 | HSD11B1 (0.47) | HSD11B1CYP2A6ALDH1A1MAPK1LMNA | |
| SCHEMBL26191582 | 0.84 | ALDH1A1 (0.54) | HSD11B1CYP2A6ALDH1A1MAPK1LMNA | |
| SCHEMBL2469822 | 0.83 | CYP2A6 (0.55) | HSD11B1CYP2A6ALDH1A1LMNATSHR | |
| SCHEMBL26191589 | 0.82 | CYP2A6 (0.52) | HSD11B1CYP2A6ALDH1A1RAB9ACA1 | |
| SCHEMBL18938474 | 0.81 | HSD11B1 (0.46) | HSD11B1CYP2A6ALDH1A1LMNATSHR | |
| SCHEMBL18795084 | 0.79 | APP (0.46) | ALDH1A1TSHRHPGDCA1CA2 | |
| SCHEMBL30097499 | 0.78 | HSD11B1 (0.55) | HSD11B1CYP2A6ALDH1A1MAPK1LMNA | |
| SCHEMBL2846646 | 0.78 | HSD11B1 (0.55) | HSD11B1CYP2A6ALDH1A1MAPK1LMNA | |
| SCHEMBL10664062 | 0.78 | HSD11B1 (0.55) | HSD11B1CYP2A6ALDH1A1MAPK1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021129072-A1 | ORGANIC COMPOUND, ELECTRONIC COMPONENT CONTAINING ORGANIC COMPOUND, AND ELECTRONIC DEVICE | 陕西莱特光电材料股份有限公司 | 2021-07-01 | — | — | WO | disclosed |