Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2B | P41595 | 1/20 | 0.42 |
| ▸ | GRM2 | Q14416 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 11/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9225959 | 0.82 | PDK1 (0.46) | HTR2BGRM2KDM4EALDH1A1TSHR | |
| SCHEMBL9225971 | 0.82 | PDK1 (0.46) | HTR2BGRM2KDM4EALDH1A1TSHR | |
| SCHEMBL11071694 | 0.81 | PARP1 (0.44) | HTR2BGRM2KDM4EALDH1A1HSD17B10 | |
| SCHEMBL11067676 | 0.78 | GRM2 (0.39) | HTR2BGRM2 | |
| SCHEMBL11060976 | 0.78 | GRM2 (0.43) | HTR2BGRM2 | |
| SCHEMBL11067481 | 0.77 | GRM2 (0.38) | HTR2BGRM2 | |
| SCHEMBL11220571 | 0.76 | HTR1A (0.45) | KDM4EALDH1A1TSHR | |
| SCHEMBL11875374 | 0.76 | HTR2B (0.47) | HTR2BGRM2 | |
| SCHEMBL11068306 | 0.74 | ADRB2 (0.44) | HTR2BGRM2NPC1 | |
| SCHEMBL11071828 | 0.73 | HTR2B (0.37) | HTR2BGRM2KDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4473501-A | HYPOTENSIVES | G. D. SEARLE & CO. (US) | 1984-09-25 | — | — | US | disclosed |
| EP-0064294-A1 | 1,5-Substituted isoquinoline derivatives | G.D. Searle & Co. (US) | 1982-11-10 | — | — | EP | disclosed |