Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.54 |
| ▸ | USP2 | O75604 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 4/20 | 0.48 |
| ▸ | RAB9A | P51151 | 4/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | SERPINE1 | P05121 | 2/20 | 0.47 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.47 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL29803818 | 0.92 | SLC2A1 (0.52) | MEN1KMT2AADRB1USP2ALDH1A1 | |
| SCHEMBL29803340 | 0.90 | ADRB1 (0.54) | MEN1KMT2AADRB1ALDH1A1MAPT | |
| SCHEMBL29803710 | 0.89 | MEN1 (0.50) | MEN1KMT2AADRB1USP2ALDH1A1 | |
| SCHEMBL29803509 | 0.86 | HTR2A (0.43) | MEN1KMT2AADRB1HDAC3HTR2A | |
| SCHEMBL24669493 | 0.86 | HTR2A (0.43) | MEN1KMT2AADRB1HDAC3HTR2A | |
| Hydrochloric Acid SCHEMBL29803793 | 0.85 | HTR2A (0.43) | MEN1KMT2AADRB1HDAC3ITGB3 | |
| SCHEMBL24671205 | 0.84 | NPC1 (0.53) | MEN1KMT2AHDAC3HDAC8NPC1 | |
| SCHEMBL24670161 | 0.84 | NPC1 (0.53) | MEN1KMT2AHDAC3HDAC8NPC1 | |
| SCHEMBL24670125 | 0.84 | OPRM1 (0.53) | KMT2AADRB1ALDH1A1HDAC3HDAC8 | |
| SCHEMBL8321062 | 0.83 | KIT (0.48) | KMT2AUSP2ALDH1A1HSD17B10MAPT |
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 |