Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.53 |
| ▸ | RAB9A | P51151 | 6/20 | 0.53 |
| ▸ | PKM | P14618 | 3/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | DHODH | Q02127 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | PIM1 | P11309 | 1/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.46 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.46 |
| ▸ | FLT3 | P36888 | 1/20 | 0.46 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.46 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7877015 | 0.85 | NPC1 (0.53) | NPC1RAB9APKMPOLBSMN1; SMN2 | |
| SCHEMBL7876552 | 0.83 | NPC1 (0.50) | NPC1RAB9APKMPOLBSMN1; SMN2 | |
| SCHEMBL3890654 | 0.83 | GAA (0.49) | NPC1RAB9APKMPOLBSMN1; SMN2 | |
| SCHEMBL9586718 | 0.78 | NPC1 (0.56) | NPC1RAB9APKMPOLBSMN1; SMN2 | |
| SCHEMBL9586710 | 0.78 | NPC1 (0.56) | NPC1RAB9APKMPOLBSMN1; SMN2 | |
| SCHEMBL1147615 | 0.77 | NPC1 (0.63) | NPC1RAB9APKMSMN1; SMN2LMNA | |
| SCHEMBL1185009 | 0.77 | NPC1 (0.63) | NPC1RAB9APKMPOLBSMN1; SMN2 | |
| SCHEMBL9080412 | 0.77 | NPC1 (0.63) | NPC1RAB9APKMSMN1; SMN2LMNA | |
| SCHEMBL14381991 | 0.77 | DHODH (0.56) | NPC1RAB9APKMPOLBSMN1; SMN2 | |
| SCHEMBL1515626 | 0.76 | NPC1 (0.53) | NPC1RAB9APKMPOLBSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6329400-B1 | INHIBITION OR ANTAGONISM OF MATRIX METALLOPROTEASES, AND/OR TUMOR NECROSIS FACTOR-ALPHA; EXTRACELLULAR MATRIX DEGRADATION, INHIBITION OF SHEDDING OF CELL SURFACE PROTEIN ECTODOMAINS AND CD23 PROTEOLYSIS | GLAXO WELLCOME INC. | 2001-12-11 | — | — | US | disclosed |