Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | MDM2 | Q00987 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | LDHA | P00338 | 1/20 | 0.40 |
| ▸ | LDHB | P07195 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30142574 | 1.00 | ADRA1A (0.44) | ADRA1AMDM2KDM4EHTTALDH1A1 | |
| SCHEMBL28507495 | 1.00 | ADRA1A (0.44) | ADRA1AMDM2KDM4EHTTALDH1A1 | |
| SCHEMBL30142577 | 0.81 | SIRT2 (0.43) | KDM4EALDH1A1TSHRMAPK1KMT2A | |
| SCHEMBL28509931 | 0.81 | SIRT2 (0.43) | KDM4EALDH1A1TSHRMAPK1KMT2A | |
| SCHEMBL30142571 | 0.81 | HTR2C (0.49) | ALDH1A1KMT2ATP53 | |
| SCHEMBL28507777 | 0.81 | HTR2C (0.49) | ALDH1A1KMT2ATP53 | |
| SCHEMBL30142575 | 0.81 | CYP19A1 (0.43) | KDM4EALDH1A1TSHRMAPK1TAAR1 | |
| SCHEMBL28507781 | 0.81 | HTR2C (0.49) | ALDH1A1KMT2ATP53 | |
| SCHEMBL30444340 | 0.81 | HTR2C (0.49) | ALDH1A1KMT2ATP53 | |
| SCHEMBL658251 | 0.80 | HTT (0.47) | ADRA1AMDM2KDM4EHTTALDH1A1 |
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-112251479-A | Method for synthesizing chiral oxazolidinone compound by double-enzyme cascade catalysis | 遵义医科大学 | 2021-01-22 | — | — | CN | disclosed |