Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 2/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | DPP4 | P27487 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | PTPRC | P08575 | 1/20 | 0.38 |
| ▸ | ELANE | P08246 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL30097499 | 0.83 | HSD11B1 (0.55) | HSD11B1CYP2A6DPP4ALDH1A1MAPK1 | |
| SCHEMBL10664062 | 0.83 | HSD11B1 (0.55) | HSD11B1CYP2A6DPP4ALDH1A1MAPK1 | |
| SCHEMBL2846646 | 0.83 | HSD11B1 (0.55) | HSD11B1CYP2A6DPP4ALDH1A1MAPK1 | |
| SCHEMBL20961072 | 0.82 | HSD11B1 (0.46) | HSD11B1CYP2A6ALDH1A1MAPK1LMNA | |
| SCHEMBL19501161 | 0.81 | HSD11B1 (0.53) | HSD11B1CYP2A6DPP4ALDH1A1MAPK1 | |
| SCHEMBL29385608 | 0.80 | CYP2A6 (0.52) | HSD11B1CYP2A6DPP4ALDH1A1MAPK1 | |
| SCHEMBL381601 | 0.80 | CYP2A6 (0.52) | HSD11B1CYP2A6DPP4ALDH1A1MAPK1 | |
| SCHEMBL18593183 | 0.78 | HSD11B1 (0.43) | HSD11B1CYP2A6DPP4ALDH1A1MAPK1 | |
| SCHEMBL31448463 | 0.78 | DPP4 (0.44) | HSD11B1CYP2A6DPP4ALDH1A1MAPK1 | |
| SCHEMBL19656484 | 0.78 | HSD11B1 (0.43) | HSD11B1CYP2A6DPP4ALDH1A1MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110799509-A | PD-1/PD-L1 inhibitors | 吉利德科学公司 | 2020-02-14 | — | — | CN | disclosed |