Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | XBP1 | P17861 | 1/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.46 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.46 |
| ▸ | CES2 | O00748 | 1/20 | 0.46 |
| ▸ | CES1 | P23141 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.44 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6490357 | 0.87 | DHODH (0.60) | DHODHKDM4EHPGDSRD5A2FFAR1 | |
| SCHEMBL6492374 | 0.79 | DHODH (0.55) | DHODHHTTLMNAMAPTKMT2A | |
| SCHEMBL6499129 | 0.79 | HSD17B10 (0.51) | DHODHLMNAKDM4EHPGDPRKAB2 | |
| SCHEMBL8561883 | 0.77 | KDM4E (0.50) | DHODHHTTLMNAMAPTKMT2A | |
| SCHEMBL10886306 | 0.77 | SLC6A4 (0.50) | MAPTKMT2AKDM4EHPGDSRD5A2 | |
| SCHEMBL13494486 | 0.76 | NOTUM (0.44) | LMNAKMT2AKDM4EMEN1HPGD | |
| SCHEMBL1045006 | 0.76 | AHR (0.57) | SRD5A2TP53 | |
| SCHEMBL23758169 | 0.75 | SLC6A4 (0.56) | HTTLMNAMAPTKMT2AKDM4E | |
| SCHEMBL3741692 | 0.75 | FFAR1 (0.57) | DHODHHTTLMNAMAPTKMT2A | |
| SCHEMBL16882044 | 0.75 | KMT2A (0.48) | LMNAMAPTKMT2AMEN1CES2 |
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-108586447-B | Benzodiazepine compound and preparation method and application thereof | 中国人民解放军第四军医大学 | 2021-01-29 | — | — | CN | disclosed |