Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 6/20 | 0.36 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | TMPRSS2 | O15393 | 2/20 | 0.34 |
| ▸ | BTK | Q06187 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.34 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.34 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.34 |
| ▸ | NAMPT | P43490 | 2/20 | 0.33 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.33 |
| ▸ | CDK9 | P50750 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29802955 | 0.89 | TMPRSS2 (0.45) | MAPTTP53TRPV1TMPRSS2BTK | |
| SCHEMBL24671223 | 0.89 | TMPRSS2 (0.45) | MAPTTP53TRPV1TMPRSS2BTK | |
| SCHEMBL24892060 | 0.88 | MAPT (0.33) | MAPTTP53TRPV1MAPK3MAPK1 | |
| SCHEMBL24891781 | 0.87 | NPC1 (0.41) | MAPTTP53NPC1ALDH1A1HPGD | |
| SCHEMBL24671334 | 0.87 | TMPRSS2 (0.43) | MAPTTP53TMPRSS2NAMPTLMNA | |
| SCHEMBL30181237 | 0.85 | MAPT (0.38) | MAPTBTKNPC1ALDH1A1HPGD | |
| SCHEMBL24891713 | 0.83 | NPC1 (0.40) | MAPTNPC1ALDH1A1HPGDALOX15 | |
| Hydrochloric Acid SCHEMBL30182348 | 0.82 | NPC1 (0.41) | MAPTTP53NPC1ALDH1A1HPGD | |
| SCHEMBL24891740 | 0.81 | NPC1 (0.41) | MAPTNPC1ALDH1A1HPGDALOX15 | |
| SCHEMBL24892101 | 0.81 | BTK (0.41) | MAPTTRPV1MAPK1BTKNPC1 |
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 | claimed |
| 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 |