Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | SRC | P12931 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.38 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.37 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TKT | P29401 | 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 | |
|---|---|---|---|---|
| SCHEMBL28389311 | 0.87 | CYP4F2 (0.54) | ALDH1A1CYP4F2CYP4A11KDM4EMAPT | |
| SCHEMBL2059540 | 0.85 | TSHR (0.50) | TSHREGFRSRCTDP1ALDH1A1 | |
| SCHEMBL18665396 | 0.81 | CYP4F2 (0.43) | TSHRTDP1ALDH1A1POLBCYP4F2 | |
| SCHEMBL20194551 | 0.78 | TSHR (0.42) | TSHRTDP1ALDH1A1POLBCYP4F2 | |
| SCHEMBL584923 | 0.78 | CYP4F2 (0.45) | TSHRTDP1ALDH1A1POLBCYP4F2 | |
| SCHEMBL8914213 | 0.77 | CYP4F2 (0.51) | TSHRTDP1ALDH1A1CYP4F2CYP4A11 | |
| SCHEMBL27584050 | 0.75 | EGFR (0.43) | TSHREGFRSRCTDP1ALDH1A1 | |
| SCHEMBL12955273 | 0.75 | CYP4F2 (0.43) | TSHRTDP1ALDH1A1POLBCYP4F2 | |
| SCHEMBL13492632 | 0.74 | CYP4F2 (0.44) | TSHRTDP1POLBCYP4F2CYP4A11 | |
| SCHEMBL28929865 | 0.74 | TNKS2 (0.38) | TSHREGFRSRCTDP1POLB |
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-106191147-A | The amino acid whose preparation method of chiral beta | 凯莱英医药集团（天津）股份有限公司 | 2016-12-07 | — | — | CN | disclosed |