Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.33 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CD44 | P16070 | 1/20 | 0.32 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL570477 | 0.83 | ESR1 (0.51) | ESR1KCNH2CYP3A4TSHRPIK3CA | |
| SCHEMBL10693501 | 0.81 | FDPS (0.38) | CYP3A4TSHRCYP1A2KDM4EAGTR1 | |
| SCHEMBL28107514 | 0.79 | CYP1A2 (0.41) | CYP3A4TSHRALDH1A1CYP1A2KDM4E | |
| SCHEMBL635759 | 0.77 | CYP3A4 (0.56) | ESR1KCNH2CYP3A4TSHRPIK3CA | |
| SCHEMBL29416116 | 0.76 | ESR1 (0.51) | ESR1KCNH2CYP3A4TSHRPIK3CA | |
| SCHEMBL19469882 | 0.76 | ESR1 (0.51) | ESR1KCNH2CYP3A4TSHRPIK3CA | |
| SCHEMBL19469880 | 0.76 | ESR1 (0.51) | ESR1KCNH2CYP3A4TSHRPIK3CA | |
| SCHEMBL11781958 | 0.75 | CYP1A2 (0.41) | KCNH2CYP3A4TSHRPIK3CAALDH1A1 | |
| Hydrochloric Acid SCHEMBL10983053 | 0.75 | CYP3A4 (0.54) | ESR1KCNH2CYP3A4TSHRPIK3CA | |
| SCHEMBL27830279 | 0.75 | TSHR (0.33) | CYP3A4TSHRPIK3CAALDH1A1CYP1A2 |
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-104350084-B | There is the polymer of the end structure having multiple reactive silicon and manufacture method thereof and utilization | 株式会社钟化 | 2016-10-12 | — | — | CN | disclosed |