Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 10/20 | 0.76 |
| ▸ | RAB9A | P51151 | 10/20 | 0.76 |
| ▸ | MEN1 | O00255 | 2/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.66 |
| ▸ | KDM1A | O60341 | 4/20 | 0.65 |
| ▸ | MAOA | P21397 | 4/20 | 0.65 |
| ▸ | MAOB | P27338 | 4/20 | 0.65 |
| ▸ | KDM1B | Q8NB78 | 4/20 | 0.65 |
| ▸ | RCOR1 | Q9UKL0 | 4/20 | 0.65 |
| ▸ | MAPT | P10636 | 3/20 | 0.63 |
| ▸ | HPGD | P15428 | 2/20 | 0.63 |
| ▸ | TSHR | P16473 | 1/20 | 0.63 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.63 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.63 |
| ▸ | POLB | P06746 | 1/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.61 |
| ▸ | TP53 | P04637 | 1/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL24891825 | 0.92 | RAB9A (0.64) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL1663115 | 0.87 | ALDH1A1 (0.66) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL8769785 | 0.87 | RAB9A (0.59) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL1663965 | 0.87 | NPC1 (0.82) | NPC1RAB9AMEN1KMT2AKDM1A | |
| SCHEMBL12333906 | 0.86 | NPC1 (0.80) | NPC1RAB9AMEN1KMT2AKDM1A | |
| SCHEMBL12082773 | 0.86 | RAB9A (1.00) | NPC1RAB9AMEN1KMT2AKDM1A | |
| SCHEMBL17801122 | 0.85 | NPC1 (0.75) | NPC1RAB9AMEN1KMT2AMAOB | |
| SCHEMBL1999202 | 0.85 | MAPKAPK2 (0.65) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL3061178 | 0.85 | NPC1 (0.78) | NPC1RAB9AMEN1KMT2AKDM1A | |
| SCHEMBL5084566 | 0.85 | USP2 (0.66) | NPC1RAB9AMEN1KMT2AMAPT |
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 |