Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.63 |
| ▸ | MAPT | P10636 | 3/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.63 |
| ▸ | HPGD | P15428 | 2/20 | 0.63 |
| ▸ | CASP1 | P29466 | 2/20 | 0.63 |
| ▸ | CASP7 | P55210 | 2/20 | 0.63 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.63 |
| ▸ | MEN1 | O00255 | 2/20 | 0.63 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.63 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.42 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.35 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL127911 | 0.94 | KMT2A (0.55) | CYP3A4MAPTKMT2AKDM4EALDH1A1 | |
| SCHEMBL13076467 | 0.86 | KDM4E (0.74) | CYP3A4MAPTKMT2AKDM4EALDH1A1 | |
| SCHEMBL179694 | 0.83 | CYP3A4 (0.74) | CYP3A4MAPTKMT2AKDM4EALDH1A1 | |
| SCHEMBL13076482 | 0.82 | KDM4E (0.72) | CYP3A4MAPTKMT2AKDM4EALDH1A1 | |
| SCHEMBL13076465 | 0.82 | CYP3A4 (0.65) | CYP3A4MAPTKMT2AKDM4EALDH1A1 | |
| SCHEMBL13076896 | 0.81 | CYP3A4 (0.74) | CYP3A4MAPTKMT2AKDM4EALDH1A1 | |
| SCHEMBL13076470 | 0.81 | MAPT (0.63) | CYP3A4MAPTKMT2AKDM4EALDH1A1 | |
| SCHEMBL192425 | 0.81 | CYP3A4 (0.68) | CYP3A4MAPTKMT2AKDM4EALDH1A1 | |
| SCHEMBL13076900 | 0.81 | CYP3A4 (0.46) | CYP3A4MAPTKMT2AKDM4EALDH1A1 | |
| SCHEMBL278878 | 0.80 | KDM4E (0.97) | CYP3A4MAPTKMT2AKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010127307-A1 | ANTIMICROBIAL AGENTS | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2010-11-04 | — | — | WO | disclosed |