Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 3/20 | 0.43 |
| ▸ | ADH1A | P07327 | 3/20 | 0.43 |
| ▸ | ADH7 | P40394 | 3/20 | 0.43 |
| ▸ | ADH1C | P00326 | 2/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | ADH4 | P08319 | 1/20 | 0.39 |
| ▸ | KDM5A | P29375 | 7/20 | 0.39 |
| ▸ | KDM4C | Q9H3R0 | 5/20 | 0.38 |
| ▸ | PHF8 | Q9UPP1 | 2/20 | 0.37 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 7/20 | 0.35 |
| ▸ | KDM5C | P41229 | 1/20 | 0.35 |
| ▸ | KDM5B | Q9UGL1 | 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 | |
|---|---|---|---|---|
| SCHEMBL16995352 | 0.91 | ADH1B (0.36) | ADH1BADH1AADH7ADH1CEPHX1 | |
| SCHEMBL9726709 | 0.87 | ADH1B (0.56) | ADH1BADH1AADH7ADH1CEPHX1 | |
| SCHEMBL16995385 | 0.86 | ADH1B (0.43) | ADH1BADH1AADH7ADH1CEPHX1 | |
| SCHEMBL18938102 | 0.84 | CAMK2A (0.32) | ADH1BADH1AADH7KDM5AKDM4C | |
| SCHEMBL3199687 | 0.82 | FFAR3 (0.52) | KDM5AKDM4CPHF8FFAR3HDAC3 | |
| SCHEMBL9621247 | 0.82 | FFAR3 (0.52) | KDM5AKDM4CPHF8FFAR3HDAC3 | |
| SCHEMBL8194762 | 0.80 | FFAR3 (0.50) | KDM5AKDM4CPHF8FFAR3HDAC3 | |
| Ammonia Solution, Strong SCHEMBL28145013 | 0.80 | FFAR3 (0.50) | KDM5AKDM4CPHF8FFAR3HDAC3 | |
| SCHEMBL11585196 | 0.80 | FFAR3 (0.50) | KDM5AKDM4CPHF8FFAR3HDAC3 | |
| SCHEMBL28143872 | 0.80 | FFAR3 (0.50) | KDM5AKDM4CPHF8FFAR3HDAC3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2576586-B1 | C-28 AMIDES OF MODIFIED C-3 BETULINIC ACID DERIVATIVES AS HIV MATURATION INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2015-08-12 | — | — | EP | disclosed |