Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.35 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.35 |
| ▸ | MIF | P14174 | 2/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL16795611 | 0.79 | CYP2A6 (0.41) | APPHDAC6CYP19A1MAOBMIF | |
| SCHEMBL16795532 | 0.79 | ALDH1A1 (0.43) | APPHDAC6MAOBPSMB8MIF | |
| SCHEMBL21355070 | 0.78 | CA12 (0.44) | CA12CA9APPHDAC6CYP19A1 | |
| SCHEMBL17221188 | 0.77 | HDAC6 (0.54) | CA12CA9APPHDAC6CYP19A1 | |
| SCHEMBL2056154 | 0.77 | CA12 (0.46) | CA12CA9APPHDAC6CYP19A1 | |
| SCHEMBL2098332 | 0.77 | CA12 (0.42) | CA12CA9APPHDAC6CYP19A1 | |
| SCHEMBL17221164 | 0.77 | LOXL2 (0.58) | CA12CA9APPHDAC6CYP19A1 | |
| SCHEMBL112634 | 0.77 | LOXL2 (0.58) | CYP19A1MAOBMEN1KMT2AKDM4E | |
| SCHEMBL1287540 | 0.76 | ALDH1A1 (0.53) | CA12CA9APPMAOBMEN1 | |
| SCHEMBL10674648 | 0.74 | LOXL2 (0.42) | CA12CA9APPCYP19A1MAOB |
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-2015087094-A1 | NEW ARYLALKENYLPROPARGYLAMINE DERIVATIVES EXHIBITING NEUROPROTECTIVE ACTION FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES | SEMMELWEIS EGYETEM (HU) | 2015-06-18 | — | — | WO | disclosed |