Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.51 |
| ▸ | RAB9A | P51151 | 4/20 | 0.49 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
| ▸ | MMP9 | P14780 | 1/20 | 0.47 |
| ▸ | MMP8 | P22894 | 1/20 | 0.47 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.45 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.45 |
| ▸ | CTSK | P43235 | 2/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ECE1 | P42892 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4205816 | 0.88 | NPC1 (0.48) | NPC1RAB9AMMP2MMP9MMP8 | |
| SCHEMBL12304173 | 0.86 | NPC1 (0.56) | NPC1RAB9AMMP2MMP9MMP8 | |
| SCHEMBL4204830 | 0.85 | NPC1 (0.46) | NPC1RAB9AMMP2MMP9MMP8 | |
| SCHEMBL11911576 | 0.85 | NPC1 (0.51) | NPC1RAB9AHDAC3NCOR2 | |
| SCHEMBL23623799 | 0.85 | NPC1 (0.54) | NPC1RAB9AMMP2MMP9MMP8 | |
| SCHEMBL7370874 | 0.84 | MMP2 (0.53) | NPC1RAB9AMMP2MMP9MMP8 | |
| SCHEMBL11911567 | 0.84 | NPC1 (0.53) | NPC1RAB9AMMP2HDAC3NCOR2 | |
| SCHEMBL4195909 | 0.83 | NPC1 (0.44) | NPC1RAB9ACTSKHDAC3NCOR2 | |
| SCHEMBL11911575 | 0.83 | NPC1 (0.49) | NPC1RAB9AHDAC3NCOR2 | |
| SCHEMBL38657612 | 0.82 | NPC1 (0.51) | NPC1RAB9AMMP2MMP9MMP8 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0287605-A1 | AMINO-2 ETHANETHIOL DERIVATIVES, PREPARATION AND THERAPEUTIC APPLICATION THEREOF | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) | 1988-10-26 | — | — | EP | disclosed |
| WO-1988002363-A1 | AMINO-2 ETHANETHIOL DERIVATIVES, PREPARATION AND THERAPEUTIC APPLICATION THEREOF | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE M (FR) | 1988-04-07 | — | — | WO | disclosed |