Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.51 |
| ▸ | MGLL | Q99685 | 5/20 | 0.48 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.46 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.46 |
| ▸ | FDPS | P14324 | 1/20 | 0.45 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.45 |
| ▸ | CDK2 | P24941 | 2/20 | 0.44 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.44 |
| ▸ | CDK3 | Q00526 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL28219940 | 0.82 | MAP3K5 (0.49) | MAP3K5FDPSCDK2RAB9AKMT2A | |
| SCHEMBL5013515 | 0.81 | CCNE1 (0.50) | MGLLERCC1ERCC4OPRK1CDK2 | |
| SCHEMBL28347289 | 0.81 | MAP3K5 (0.50) | MAP3K5FDPSCDK2RAB9AKMT2A | |
| SCHEMBL28219941 | 0.81 | MAP3K5 (0.50) | MAP3K5FDPSCDK2RAB9AALDH1A1 | |
| SCHEMBL28357831 | 0.80 | CCNK (0.53) | MAP3K5FDPSCDK2RAB9AALDH1A1 | |
| SCHEMBL5022949 | 0.78 | ADORA3 (0.43) | MGLLERCC1ERCC4OPRK1CDK2 | |
| SCHEMBL28224833 | 0.77 | ADORA1 (0.52) | MAP3K5FDPSCDK2RAB9AALDH1A1 | |
| SCHEMBL2267481 | 0.76 | FDPS (0.48) | MAP3K5FDPSRAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL31143762 | 0.76 | MAP3K5 (0.54) | MAP3K5FDPSCDK2ALDH1A1MAPT | |
| SCHEMBL8986816 | 0.76 | MAP3K5 (0.54) | MAP3K5FDPSCDK2ALDH1A1MAPT |
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-108125959-B | Application of dimethoxy phenylamino acetamido quinazoline compound in preparation of drugs for treating leukemia | 浙江工业大学 | 2019-12-31 | — | — | CN | disclosed |