Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | GSK3B | P49841 | 2/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.46 |
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.42 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.42 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | CRHBP | P24387 | 1/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 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 | |
|---|---|---|---|---|
| SCHEMBL8375834 | 1.00 | NPSR1 (0.51) | NPSR1GSK3BPTPN1CES2CES1 | |
| SCHEMBL859597 | 0.81 | CES2 (0.60) | NPSR1GSK3BPTPN1CES2CES1 | |
| SCHEMBL8375792 | 0.80 | SMN1; SMN2 (0.50) | GSK3BCES2CES1MAPTALDH1A1 | |
| SCHEMBL8375797 | 0.80 | SMN1; SMN2 (0.50) | GSK3BCES2CES1MAPTALDH1A1 | |
| SCHEMBL1054614 | 0.79 | ALDH1A1 (0.56) | NPSR1MAPTALDH1A1KMT2AKDM4E | |
| SCHEMBL11821119 | 0.79 | ALDH1A1 (0.56) | NPSR1MAPTALDH1A1KMT2AKDM4E | |
| SCHEMBL840765 | 0.78 | NPSR1 (0.54) | NPSR1GSK3BPTPN1CES2CES1 | |
| SCHEMBL668192 | 0.77 | CA12 (0.61) | NPSR1CES2CES1MAPTKMT2A | |
| SCHEMBL23332553 | 0.77 | NPSR1 (0.52) | NPSR1GSK3BPTPN1CES2CES1 | |
| SCHEMBL4478898 | 0.77 | NPSR1 (0.52) | NPSR1GSK3BPTPN1CES2CES1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6005116-A | HAVE INHIBITION ACTIVITIES AGAINST TYPE A-MONOAMINE OXIDASE; TREATING OR PREVENTING DEPRESSION, PARKINSON'S DISEASE, ALZEHEIMER'S DEMENTIA, OR CEREBROVASCULAR DEMENTIA | SANKYO COMPANY, LIMITED (JP) | 1999-12-21 | — | — | US | disclosed |
| EP-0885891-A1 | ISOXAZOLE DERIVATIVES | SANKYO COMPANY LIMITED (JP) | 1998-12-23 | — | — | EP | disclosed |