Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 14/20 | 0.53 |
| ▸ | RAB9A | P51151 | 13/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.53 |
| ▸ | MAPT | P10636 | 6/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.53 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.53 |
| ▸ | RELA | Q04206 | 1/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | CASP3 | P42574 | 1/20 | 0.46 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | AR | P10275 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL24670530 | 0.83 | MAPT (0.45) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL11191679 | 0.74 | HSD17B10 (0.72) | NPC1RAB9ASMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL21653125 | 0.73 | BRD4 (0.40) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL7057048 | 0.71 | GAA (0.43) | NPC1RAB9ASMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL8042295 | 0.70 | RAB9A (0.81) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL1753199 | 0.70 | RAB9A (0.81) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL822378 | 0.70 | RAB9A (1.00) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL12310125 | 0.70 | RAB9A (1.00) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL15214321 | 0.70 | RAB9A (1.00) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL14580374 | 0.70 | RAB9A (1.00) | NPC1RAB9ASMN1; SMN2MAPTTP53 |
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-2022192162-A1 | NOVEL HETEROAROMATIC COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE | FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) | 2022-09-15 | — | — | WO | disclosed |