Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 8/20 | 0.65 |
| ▸ | RAB9A | P51151 | 7/20 | 0.65 |
| ▸ | LMNA | P02545 | 6/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.63 |
| ▸ | GAA | P10253 | 3/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.63 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.52 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.52 |
| ▸ | RELA | Q04206 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.51 |
| ▸ | CASP3 | P42574 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL29803616 | 1.00 | NPC1 (0.65) | NPC1RAB9ALMNASMN1; SMN2GAA | |
| SCHEMBL3846749 | 0.94 | NPC1 (0.59) | NPC1RAB9ALMNASMN1; SMN2GAA | |
| SCHEMBL3848971 | 0.91 | RAB9A (0.70) | NPC1RAB9ALMNASMN1; SMN2GAA | |
| SCHEMBL14695827 | 0.86 | NPC1 (0.55) | NPC1RAB9ALMNASMN1; SMN2GAA | |
| SCHEMBL23242595 | 0.85 | NPC1 (0.55) | NPC1RAB9ALMNASMN1; SMN2GAA | |
| SCHEMBL29800850 | 0.85 | NPC1 (0.55) | NPC1RAB9ALMNASMN1; SMN2GAA | |
| SCHEMBL13098104 | 0.83 | NPC1 (0.57) | NPC1RAB9ALMNASMN1; SMN2GAA | |
| SCHEMBL3849125 | 0.83 | RAB9A (0.56) | NPC1RAB9ALMNASMN1; SMN2GAA | |
| SCHEMBL13485811 | 0.82 | DGAT1 (0.63) | NPC1RAB9ALMNASMN1; SMN2GAA | |
| SCHEMBL27007857 | 0.82 | DGAT1 (0.63) | NPC1RAB9ALMNASMN1; SMN2GAA |
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-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 |
| 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 |