Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 13/20 | 0.64 |
| ▸ | RAB9A | P51151 | 13/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.64 |
| ▸ | MAPT | P10636 | 5/20 | 0.64 |
| ▸ | TP53 | P04637 | 2/20 | 0.64 |
| ▸ | TSHR | P16473 | 2/20 | 0.64 |
| ▸ | PKM | P14618 | 3/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.60 |
| ▸ | QSOX1 | O00391 | 1/20 | 0.60 |
| ▸ | LMNA | P02545 | 1/20 | 0.60 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.59 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.59 |
| ▸ | RELA | Q04206 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.57 |
| ▸ | HTT | P42858 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.56 |
| ▸ | USP2 | O75604 | 2/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL13216227 | 0.91 | NPC1 (0.61) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL13236317 | 0.91 | RAB9A (0.57) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL13216198 | 0.91 | NPC1 (0.67) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL532678 | 0.90 | MAPT (0.74) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL3956530 | 0.89 | MAPT (0.65) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL15652245 | 0.89 | NPC1 (0.55) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL24891825 | 0.88 | RAB9A (0.64) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL5084566 | 0.84 | USP2 (0.66) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL8769785 | 0.84 | RAB9A (0.59) | NPC1RAB9ASMN1; SMN2MAPTTP53 | |
| SCHEMBL1663115 | 0.84 | ALDH1A1 (0.66) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023287736-A1 | NOVEL BIS-AMIDE CONTAINING COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE | FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) | 2023-01-19 | — | — | WO | disclosed |
| WO-2023287736-A1 | NOVEL BIS-AMIDE CONTAINING COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE | FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) | 2023-01-19 | — | — | WO | disclosed |