Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | ELANE | P08246 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | NR4A2 | P43354 | 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 | |
|---|---|---|---|---|
| SCHEMBL30839807 | 0.84 | TSHR (0.46) | ALDH1A1MAPK1TSHRHSD17B10CYP2A6 | |
| SCHEMBL16347053 | 0.84 | TSHR (0.46) | ALDH1A1MAPK1TSHRHSD17B10CYP2A6 | |
| SCHEMBL31448463 | 0.83 | DPP4 (0.44) | HSD11B1ALDH1A1MAPK1ELANETSHR | |
| SCHEMBL9501878 | 0.80 | — | — | |
| SCHEMBL30042309 | 0.80 | — | — | |
| SCHEMBL30097499 | 0.80 | HSD11B1 (0.55) | HSD11B1ALDH1A1MAPK1ELANETSHR | |
| SCHEMBL10664062 | 0.80 | HSD11B1 (0.55) | HSD11B1ALDH1A1MAPK1ELANETSHR | |
| SCHEMBL2846646 | 0.80 | HSD11B1 (0.55) | HSD11B1ALDH1A1MAPK1ELANETSHR | |
| SCHEMBL20345882 | 0.78 | ALDH1A1 (0.59) | ALDH1A1MAPK1TSHRHSD17B10CYP2A6 | |
| SCHEMBL20961072 | 0.78 | HSD11B1 (0.46) | HSD11B1ALDH1A1MAPK1ELANETSHR |
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-117447437-A | Large conjugated twisted molecule and electroluminescent device | 西安欧得光电材料有限公司 | 2024-01-26 | — | — | CN | disclosed |