Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 2/20 | 0.43 |
| ▸ | DRD4 | P21917 | 2/20 | 0.43 |
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | ALPL | P05186 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL24528952 | 0.84 | KDM1A (0.49) | BCHEDRD2DRD4KDM1AKDM4E | |
| Bromide SCHEMBL27191476 | 0.82 | KDM1A (0.48) | BCHEDRD2DRD4KDM1AKDM4E | |
| Bromide SCHEMBL30645337 | 0.82 | KDM1A (0.48) | BCHEDRD2DRD4KDM1AKDM4E | |
| SCHEMBL8513919 | 0.77 | BCHE (0.44) | BCHEDRD2DRD4KDM1AKDM4E | |
| SCHEMBL8469298 | 0.76 | KMT2A (0.48) | BCHEDRD2DRD4KDM1AKDM4E | |
| SCHEMBL8523114 | 0.74 | DRD2 (0.55) | DRD2DRD4KDM4E | |
| Bromide SCHEMBL9531808 | 0.73 | KDM1A (0.47) | BCHEDRD2DRD4KDM1AKDM4E | |
| SCHEMBL10348905 | 0.73 | DRD2 (0.60) | BCHEDRD2DRD4KDM1AKDM4E | |
| SCHEMBL10348897 | 0.72 | BCHE (0.74) | BCHEDRD2DRD4KDM1AKDM4E | |
| SCHEMBL10349436 | 0.72 | TBXA2R (0.74) | BCHEKDM4EMAPTPKM |
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-2012065527-A1 | COMPOUDS AND USES AS L-TYPE CALCIUM CHANNEL BLOCKER AND/OR ACETYLCHOLINESTERASE INHIBITOR THEREOF | 江苏先声药物研究有限公司 (CN) | 2012-05-24 | — | — | WO | disclosed |