Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | MAPKAPK2 | P49137 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | RELA | Q04206 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ESRRG | P62508 | 6/20 | 0.39 |
| ▸ | ESR1 | P03372 | 4/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.39 |
| ▸ | PRSS12 | P56730 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.37 |
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 SCHEMBL29803663 | 0.93 | KDM4E (0.40) | KDM4ERXFP1NPSR1MAPKAPK2NPC1 | |
| SCHEMBL24671298 | 0.87 | ESRRG (0.43) | KDM4ERXFP1NPSR1MAPKAPK2ESRRG | |
| SCHEMBL24670406 | 0.85 | IMPDH2 (0.45) | KDM4EMAPKAPK2SMN1; SMN2KMT2AALDH1A1 | |
| SCHEMBL29803733 | 0.83 | MAPKAPK2 (0.52) | KDM4ERXFP1MAPKAPK2NPC1RAB9A | |
| Trifluoroacetic Acid SCHEMBL29803840 | 0.82 | MAPT (0.39) | KDM4ERXFP1NPSR1NPC1RAB9A | |
| SCHEMBL29803327 | 0.82 | NPC1 (0.52) | KDM4EMAPKAPK2NPC1RAB9AMEN1 | |
| Hydrochloric Acid SCHEMBL29803461 | 0.80 | TP53 (0.46) | KDM4ERXFP1MAPKAPK2NPC1RAB9A | |
| Trifluoroacetic Acid SCHEMBL29803398 | 0.79 | IMPDH2 (0.41) | KDM4ESMN1; SMN2KMT2ANCOR2KCNH2 | |
| SCHEMBL24670348 | 0.78 | TP53 (0.46) | KDM4ERXFP1MAPKAPK2NPC1RAB9A | |
| SCHEMBL29803234 | 0.78 | MAPT (0.44) | KDM4ERXFP1NPSR1MAPKAPK2NPC1 |
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 |