Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR4 | Q13639 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | DAO | P14920 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8145105 | 0.86 | NPSR1 (0.47) | HTR4TP53SMN1; SMN2CYP2C19HRH3 | |
| SCHEMBL21065340 | 0.84 | CA12 (0.48) | CYP2C19NPC1MEN1KMT2AKDM4E | |
| SCHEMBL23709496 | 0.83 | TP53 (0.49) | HTR4TP53SMN1; SMN2CYP2C19HRH3 | |
| SCHEMBL15160807 | 0.81 | CYP2C19 (0.47) | HTR4TP53SMN1; SMN2CYP2C19HRH3 | |
| SCHEMBL166365 | 0.81 | HDAC2 (0.54) | HTR4CYP2C19MEN1KMT2AKDM4E | |
| SCHEMBL18705121 | 0.78 | DRD2 (0.54) | HTR4HRH3MEN1KMT2ASIGMAR1 | |
| SCHEMBL25203388 | 0.77 | CA12 (0.43) | TP53CYP2C19MEN1KMT2AKDM4E | |
| SCHEMBL165673 | 0.77 | CA12 (0.60) | NPC1MEN1KMT2ASIGMAR1KDM4E | |
| SCHEMBL23407902 | 0.76 | SMN1; SMN2 (0.57) | TP53SMN1; SMN2KDM4EALDH1A1NPSR1 | |
| SCHEMBL13745049 | 0.76 | GLA (0.50) | TP53SMN1; SMN2SIGMAR1ALDH1A1DAO |
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-2017197080-A1 | MODULATORS OF P97 AAA ATPASE ACTIVITY | UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 2017-11-16 | — | — | WO | disclosed |