Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCN1 | O60741 | 2/20 | 0.39 |
| ▸ | HCN4 | Q9Y3Q4 | 2/20 | 0.39 |
| ▸ | DHFR | P00374 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | CRHR1 | P34998 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CRHBP | P24387 | 1/20 | 0.34 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | VSIR | Q9H7M9 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9564351 | 0.73 | HCN1 (0.40) | HCN1HCN4DHFRTSHRCYP1A2 | |
| SCHEMBL9564357 | 0.71 | CYP2E1 (0.37) | HCN1HCN4DHFRTSHRCYP1A2 | |
| SCHEMBL8894118 | 0.70 | L3MBTL1 (0.52) | HCN1HCN4DHFRTSHRCYP1A2 | |
| SCHEMBL9564411 | 0.70 | SCD (0.41) | HCN1HCN4TSHRCYP1A2CYP2D6 | |
| SCHEMBL29644232 | 0.64 | BRD4 (0.50) | — | |
| SCHEMBL10729565 | 0.64 | CYP1A2 (0.48) | CYP1A2TP53MAPTNPSR1KDM4E | |
| SCHEMBL8893003 | 0.62 | TP53 (0.47) | HCN1HCN4DHFRTSHRCYP1A2 | |
| SCHEMBL9564425 | 0.61 | KDM4E (0.44) | CRHR1KDM4EMAPK1ATM | |
| SCHEMBL11507977 | 0.61 | CRHR1 (0.50) | HCN1HCN4DHFRTSHRCYP1A2 | |
| SCHEMBL8894367 | 0.61 | CYP1A2 (0.50) | HCN1HCN4DHFRTSHRCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0563686-A1 | Utilization of 3 substituted amino isoxazole derivatives against endoparasites, new 3 substituted amino isoxazols and process for their preparation | BAYER AG (DE) | 1993-10-06 | — | — | EP | disclosed |