Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.45 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | GMNN | O75496 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | FYN | P06241 | 1/20 | 0.36 |
| ▸ | CA3 | P07451 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3804953 | 0.80 | TSHR (0.50) | TSHRGABRA1GABRB2POLBHPGD | |
| SCHEMBL38665354 | 0.80 | TSHR (0.50) | TSHRGABRA1GABRB2POLBHPGD | |
| SCHEMBL16809557 | 0.80 | TSHR (0.50) | TSHRGABRA1GABRB2POLBHPGD | |
| SCHEMBL4738271 | 0.79 | TSHR (0.55) | TSHRGABRA1GABRB2POLBHPGD | |
| SCHEMBL1268939 | 0.78 | TSHR (0.44) | TSHRGABRA1GABRB2POLBHPGD | |
| SCHEMBL4981071 | 0.78 | TSHR (0.53) | TSHRGABRA1GABRB2POLBKDM4E | |
| SCHEMBL6690451 | 0.76 | TSHR (0.52) | TSHRGABRA1GABRB2POLBALDH1A1 | |
| SCHEMBL30714953 | 0.76 | TSHR (0.52) | TSHRGABRA1GABRB2POLBALDH1A1 | |
| SCHEMBL4397437 | 0.76 | TAAR1 (0.48) | TSHRGABRA1GABRB2HIF1AHSPA5 | |
| SCHEMBL1837302 | 0.76 | POLB (0.50) | TSHRPOLB |
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-105001213-B | C-aryl glycoside derivative, pharmaceutical composition, preparation method and application thereof | 上海迪诺医药科技有限公司 | 2020-08-28 | — | — | CN | disclosed |