Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.66 |
| ▸ | RAB9A | P51151 | 4/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.66 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.66 |
| ▸ | SCN4A | P35499 | 2/20 | 0.66 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.66 |
| ▸ | TP53 | P04637 | 2/20 | 0.66 |
| ▸ | GAA | P10253 | 2/20 | 0.66 |
| ▸ | GMNN | O75496 | 1/20 | 0.66 |
| ▸ | USP2 | O75604 | 1/20 | 0.66 |
| ▸ | LMNA | P02545 | 1/20 | 0.66 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.66 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.66 |
| ▸ | PKM | P14618 | 1/20 | 0.66 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.66 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.66 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.66 |
| ▸ | BLM | P54132 | 1/20 | 0.66 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.66 |
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 | |
|---|---|---|---|---|
| SCHEMBL2001392 | 0.84 | NPC1 (0.59) | NPC1RAB9ASMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL9371597 | 0.83 | NPC1 (0.54) | NPC1RAB9ASMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL18580741 | 0.82 | APP (0.58) | NPC1RAB9ASMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL17942286 | 0.81 | RAB9A (0.51) | NPC1RAB9ASMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL1988015 | 0.81 | APP (0.69) | NPC1RAB9ASMN1; SMN2CYP1A2CYP3A4 | |
| Riluzole SCHEMBL8913448 | 0.80 | RAB9A (1.00) | NPC1RAB9ASMN1; SMN2CYP1A2CYP3A4 | |
| Riluzole SCHEMBL5053829 | 0.80 | RAB9A (1.00) | NPC1RAB9ASMN1; SMN2CYP1A2CYP3A4 | |
| Riluzole SCHEMBL78905 | 0.80 | RAB9A (1.00) | NPC1RAB9ASMN1; SMN2CYP1A2CYP3A4 | |
| Riluzole SCHEMBL29359189 | 0.80 | RAB9A (1.00) | NPC1RAB9ASMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL7495276 | 0.80 | SMN1; SMN2 (0.55) | NPC1RAB9ASMN1; SMN2CYP1A2CYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5077300-A | Parasiticides | CIBA-GEIGY CORPORATION (US) | 1991-12-31 | — | — | US | claimed |
| US-5077300-A | Parasiticides | CIBA-GEIGY CORPORATION (US) | 1991-12-31 | — | — | US | disclosed |
| EP-0420805-A2 | Anthelmintic compounds | CIBA-GEIGY AG (CH) | 1991-04-03 | — | — | EP | disclosed |