Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GBA1 | P04062 | 2/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 2/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.33 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18776398 | 0.80 | KDM1A (0.42) | KDM1AHSD11B1ALDH1A1GBA1SIGMAR1 | |
| SCHEMBL12607 | 0.80 | ALDH1A1 (0.53) | ALDH1A1SIGMAR1HRH3KDM4ERECQL | |
| SCHEMBL26031963 | 0.80 | KDM1A (0.42) | KDM1AHSD11B1ALDH1A1GBA1SIGMAR1 | |
| SCHEMBL1570155 | 0.80 | HSD11B1 (0.44) | KDM1AHSD11B1ALDH1A1GBA1SIGMAR1 | |
| SCHEMBL259415 | 0.78 | GBA1 (0.44) | KDM1AHSD11B1ALDH1A1GBA1NPC1 | |
| SCHEMBL2443347 | 0.78 | KDM1A (0.41) | KDM1AHSD11B1ALDH1A1GBA1SIGMAR1 | |
| SCHEMBL18664097 | 0.78 | KDM1A (0.41) | KDM1AHSD11B1ALDH1A1GBA1SIGMAR1 | |
| SCHEMBL4761260 | 0.78 | KDM1A (0.41) | KDM1AHSD11B1ALDH1A1GBA1SIGMAR1 | |
| SCHEMBL633682 | 0.78 | KDM1A (0.41) | KDM1AHSD11B1ALDH1A1GBA1SIGMAR1 | |
| SCHEMBL14488177 | 0.78 | KDM1A (0.41) | KDM1AHSD11B1ALDH1A1GBA1SIGMAR1 |
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-2018053126-A1 | INHIBITION OF BMP SIGNALING, COMPOUNDS, COMPOSITIONS AND USES THEREOF | VANDERBILT UNIVERSITY (US) | 2018-03-22 | — | — | WO | disclosed |