Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 5/20 | 0.39 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.38 |
| ▸ | WDR5 | P61964 | 2/20 | 0.37 |
| ▸ | CDK7 | P50613 | 1/20 | 0.37 |
| ▸ | CDK13 | Q14004 | 1/20 | 0.37 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.37 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.37 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29803557 | 0.91 | NAMPT (0.51) | NAMPTALDH1A1TRPV1MAPTHTT | |
| SCHEMBL24669521 | 0.91 | NAMPT (0.51) | NAMPTALDH1A1TRPV1MAPTHTT | |
| SCHEMBL24671313 | 0.85 | WDR5 (0.43) | NAMPTPDK4WDR5CDK7CDK13 | |
| SCHEMBL24669471 | 0.83 | NAMPT (0.53) | NAMPTPDK4WDR5CDK7CDK13 | |
| SCHEMBL24669429 | 0.82 | PDK4 (0.39) | NAMPTMAPTPDK4WDR5JAK1 | |
| SCHEMBL24669408 | 0.81 | NAMPT (0.50) | NAMPTMAPTPDK4WDR5CDK7 | |
| SCHEMBL24670598 | 0.79 | PDK4 (0.39) | NAMPTPDK4WDR5JAK1GRM5 | |
| SCHEMBL24670300 | 0.78 | NAMPT (0.39) | NAMPTALDH1A1L3MBTL1TRPV1MAPT | |
| SCHEMBL24669509 | 0.78 | NAMPT (0.39) | NAMPTALDH1A1L3MBTL1TRPV1MAPT | |
| SCHEMBL29803520 | 0.78 | NAMPT (0.39) | NAMPTALDH1A1L3MBTL1TRPV1MAPT |
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 |