Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.36 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | SNCA | P37840 | 1/20 | 0.30 |
| ▸ | APP | P05067 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2659946 | 0.80 | CYP3A4 (0.44) | CYP3A4MEN1KMT2ATSHRMAPT | |
| SCHEMBL9435890 | 0.77 | CYP3A4 (0.48) | CYP3A4MEN1KMT2ATSHRMAPT | |
| SCHEMBL8650930 | 0.73 | — | — | |
| SCHEMBL14719798 | 0.73 | — | — | |
| SCHEMBL6429741 | 0.73 | — | — | |
| SCHEMBL15519306 | 0.72 | CYP3A4 (0.37) | CYP3A4TSHRMAPTCACNA1BAPBA1 | |
| SCHEMBL3257965 | 0.71 | CYP3A4 (0.39) | CYP3A4MEN1KMT2ATSHRMAPT | |
| SCHEMBL9929 | 0.71 | — | — | |
| SCHEMBL16360618 | 0.70 | — | — | |
| SCHEMBL744340 | 0.69 | — | — |
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-5290519-A | Cardiovascular disorders | DIAGNOSTIC MARKERS, INC. (US) | 1994-03-01 | — | — | US | claimed |
| US-5227307-A | Binding metals to thiol groups of tissue proteins | DIAGNOSTIC MARKERS, INC. (US) | 1993-07-13 | — | — | US | claimed |