Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNK3 | O14649 | 4/20 | 0.62 |
| ▸ | KCNK9 | Q9NPC2 | 4/20 | 0.62 |
| ▸ | RXFP1 | Q9HBX9 | 8/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL29926842 | 0.85 | NPC1 (0.58) | KCNK3KCNK9RXFP1MAPTALDH1A1 | |
| SCHEMBL29927010 | 0.81 | NPC1 (0.62) | KCNK3KCNK9RXFP1MAPTALDH1A1 | |
| SCHEMBL29926864 | 0.79 | KCNK3 (0.61) | KCNK3KCNK9RXFP1MAPTHPGD | |
| SCHEMBL4433023 | 0.75 | KCNK3 (0.84) | KCNK3KCNK9RXFP1MAPTHPGD | |
| SCHEMBL5504642 | 0.74 | MEN1 (0.83) | KCNK3KCNK9RXFP1MAPTHPGD | |
| SCHEMBL36036 | 0.74 | TSHR (0.45) | ALDH1A1HTTMEN1KMT2ATSHR | |
| SCHEMBL11780348 | 0.73 | POLB (0.67) | KCNK3KCNK9HPGDALDH1A1MEN1 | |
| SCHEMBL18893298 | 0.73 | KCNK3 (0.75) | KCNK3KCNK9RXFP1MAPTALDH1A1 | |
| SCHEMBL15528334 | 0.73 | RXFP1 (0.74) | KCNK3KCNK9RXFP1MAPTHPGD | |
| SCHEMBL29927583 | 0.71 | NPC1 (0.60) | KCNK3KCNK9RXFP1MAPTALDH1A1 |
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-2022197740-A1 | BIARYL AMIDE AND HETEROARYL AMIDES FOR TREATMENT OF CANDIDA ALBICANS INFECTION | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2022-09-22 | — | — | WO | claimed |