Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 4/20 | 0.45 |
| ▸ | XDH | P47989 | 2/20 | 0.40 |
| ▸ | GRM2 | Q14416 | 5/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 2/20 | 0.37 |
| ▸ | BAZ2A | Q9UIF9 | 2/20 | 0.37 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.37 |
| ▸ | AKT1 | P31749 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22031458 | 0.73 | KDM1A (0.81) | KDM1ARPS6KB1AKT1 | |
| SCHEMBL17375939 | 0.72 | KDM1A (0.81) | KDM1ARPS6KB1 | |
| SCHEMBL22035592 | 0.67 | KDM1A (0.63) | KDM1ACYP11B1CYP11B2 | |
| SCHEMBL13001686 | 0.63 | TSHR (0.52) | CYP11B1CYP11B2 | |
| SCHEMBL28918484 | 0.62 | XDH (0.66) | XDH | |
| SCHEMBL16651145 | 0.60 | BRD4 (0.40) | GRM2BRD4BAZ2A | |
| SCHEMBL22703631 | 0.60 | BRD4 (0.54) | BRD4BAZ2A | |
| SCHEMBL19924644 | 0.59 | BRD4 (0.65) | BRD4BAZ2A | |
| SCHEMBL18275112 | 0.59 | AR (0.67) | — | |
| SCHEMBL1816526 | 0.59 | S1PR1 (0.41) | CYP11B1CYP11B2 |
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-3160956-B1 | INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 | CELGENE QUANTICEL RES INC (US) | 2020-05-27 | — | — | EP | disclosed |