Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 2/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.36 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.36 |
| ▸ | ELANE | P08246 | 1/20 | 0.36 |
| ▸ | PRTN3 | P24158 | 1/20 | 0.36 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL4037964 | 0.74 | MAOB (0.57) | ALDH1A1MAOBLMNACA1CA2 | |
| SCHEMBL25271061 | 0.74 | MAOB (0.57) | ALDH1A1MAOBLMNACA1CA2 | |
| SCHEMBL31530734 | 0.73 | TDP1 (0.45) | ALDH1A1KMT2ALMNAKDM4EMAPT | |
| SCHEMBL4518996 | 0.72 | LMNA (0.47) | ALDH1A1KMT2ALMNAKDM4EMAPT | |
| SCHEMBL4518992 | 0.72 | LMNA (0.47) | ALDH1A1KMT2ALMNAKDM4EMAPT | |
| SCHEMBL5605632 | 0.72 | ALDH1A1 (0.42) | ALDH1A1KMT2ALMNAKDM4EMAPT | |
| SCHEMBL12580250 | 0.71 | ALDH1A1 (0.51) | ALDH1A1KMT2ALMNAHTR6KDM4E | |
| SCHEMBL14399470 | 0.71 | ALDH1A1 (0.51) | ALDH1A1KMT2ALMNAHTR6KDM4E | |
| SCHEMBL19433071 | 0.70 | MAOB (0.52) | ALDH1A1MAOBKDM4EMAPTCA1 | |
| SCHEMBL15702910 | 0.70 | MAOB (0.52) | ALDH1A1MAOBKDM4EMAPTCA1 |
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-108117499-B | Preparation method of alpha aryl amidine imine derivative | 上海应用技术大学 | 2020-10-09 | — | — | CN | disclosed |