Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | LIMK1 | P53667 | 2/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 10/20 | 0.40 |
| ▸ | PRKACA | P17612 | 2/20 | 0.39 |
| ▸ | CDK8 | P49336 | 2/20 | 0.39 |
| ▸ | MAP2K1 | Q02750 | 2/20 | 0.39 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.39 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.39 |
| ▸ | CSF1R | P07333 | 1/20 | 0.39 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27495941 | 0.77 | ESR1 (0.44) | ESR1KDRPLAAALPG | |
| SCHEMBL28062022 | 0.76 | PARL (0.42) | ESR1ALDH1A1KDM4EMAPTTDP1 | |
| SCHEMBL5192672 | 0.76 | ESR1 (0.49) | ESR1CHEK1ALDH1A1LIMK1MAPK14 | |
| SCHEMBL19065614 | 0.72 | ESR1 (0.46) | ESR1CHEK1ALDH1A1LIMK1MAPK14 | |
| SCHEMBL1263722 | 0.72 | ESR1 (0.50) | ESR1CHEK1ALDH1A1LIMK1MAPK14 | |
| SCHEMBL4482636 | 0.72 | ESR1 (0.46) | ESR1CHEK1ALDH1A1LIMK1MAPK14 | |
| SCHEMBL5533567 | 0.72 | ESR1 (0.46) | ESR1CHEK1ALDH1A1LIMK1MAPK14 | |
| SCHEMBL786747 | 0.72 | HDAC4 (0.52) | ESR1CHEK1ALDH1A1LIMK1MAPK14 | |
| SCHEMBL5324352 | 0.72 | ESR1 (0.46) | ESR1CHEK1ALDH1A1LIMK1MAPK14 | |
| SCHEMBL6440778 | 0.72 | KMT2A (0.50) | ESR1CHEK1ALDH1A1LIMK1MAPK14 |
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-106471032-A | Catalyst for synthesizing oxazolidinone compound | 科思创德国股份有限公司 | 2017-03-01 | — | — | CN | disclosed |