Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.55 |
| ▸ | TMEM97 | Q5BJF2 | 3/20 | 0.55 |
| ▸ | HTR1A | P08908 | 2/20 | 0.55 |
| ▸ | DRD4 | P21917 | 2/20 | 0.55 |
| ▸ | HTR2C | P28335 | 2/20 | 0.55 |
| ▸ | HTR2B | P41595 | 2/20 | 0.55 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.55 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.55 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.55 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.55 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.55 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.55 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.55 |
| ▸ | HTR5A | P47898 | 1/20 | 0.55 |
| ▸ | LPO | P22079 | 3/20 | 0.51 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.51 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL28179429 | 0.90 | MAOB (0.53) | SIGMAR1TMEM97HTR1ADRD4HTR2C | |
| SCHEMBL28179465 | 0.84 | CYP11B1 (0.56) | SIGMAR1LMNATP53MAPTKMT2A | |
| SCHEMBL28179455 | 0.81 | MAOB (0.55) | SIGMAR1HTR1ALPOLMNATP53 | |
| SCHEMBL28178688 | 0.80 | PDE4A (0.50) | LMNAMAPTKMT2AKDM4EMEN1 | |
| SCHEMBL28110914 | 0.79 | CYP11B1 (0.55) | LMNAMAPTKDM4EALDH1A1CYP11B1 | |
| SCHEMBL28179450 | 0.77 | TUBB4A (0.47) | LMNATP53MAPTKMT2AKDM4E | |
| SCHEMBL31061613 | 0.76 | TLR8 (0.57) | TP53 | |
| SCHEMBL28815504 | 0.76 | CYP11B1 (0.51) | SIGMAR1TP53KMT2AKDM4EMEN1 | |
| SCHEMBL28851823 | 0.76 | CYP11B1 (0.51) | SIGMAR1TP53KMT2AKDM4EMEN1 | |
| SCHEMBL31596135 | 0.75 | HDAC8 (0.41) | TP53KDM4EALDH1A1CYP11B1CYP11B2 |
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-104370793-B | Pyroles marine alkaloids Neolamellarin A analogs and its preparation method and application | 中国海洋大学 | 2017-10-17 | — | — | CN | disclosed |