Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 3/20 | 0.38 |
| ▸ | FLT3 | P36888 | 5/20 | 0.36 |
| ▸ | CD40 | P25942 | 1/20 | 0.36 |
| ▸ | CD40LG | P29965 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | ABAT | P80404 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | NAMPT | P43490 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29455204 | 0.80 | KDM4E (0.43) | ENPP2HTR2AABATSIGMAR1NAMPT | |
| SCHEMBL2705734 | 0.78 | ALDH1A1 (0.45) | CD40CD40LGHPGDHSD17B10KDM4E | |
| SCHEMBL7987999 | 0.76 | ALDH1A1 (0.43) | CD40CD40LGHPGDKDM4EALDH1A1 | |
| SCHEMBL28549864 | 0.75 | ENPP2 (0.67) | ENPP2HTR2AABATSIGMAR1HPGD | |
| SCHEMBL28549865 | 0.75 | ENPP2 (0.67) | ENPP2HTR2AABATSIGMAR1HPGD | |
| SCHEMBL29455205 | 0.75 | ENPP2 (0.67) | ENPP2HTR2AABATSIGMAR1HPGD | |
| SCHEMBL3490877 | 0.74 | CD40 (0.43) | CD40CD40LGKDM4EALDH1A1LMNA | |
| SCHEMBL13753754 | 0.74 | ALDH1A1 (0.56) | MEN1KMT2ANAMPTHPGDKDM4E | |
| SCHEMBL21323207 | 0.73 | CHRNA4 (0.55) | — | |
| SCHEMBL16962948 | 0.73 | CHRNA4 (0.55) | — |
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-112778274-B | Nitrogen-containing heterocyclic derivative and preparation thereof | 四川海思科制药有限公司 | 2022-02-15 | — | — | CN | disclosed |