Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.37 |
| ▸ | DDX3X | O00571 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.33 |
| ▸ | CPN1 | P15169 | 1/20 | 0.33 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23924224 | 0.88 | PBRM1 (0.48) | CYP3A4CASP1RECQLPBRM1NPSR1 | |
| SCHEMBL11682083 | 0.82 | NPSR1 (0.54) | NPSR1ALDH1A1TDP1TSHRNPC1 | |
| SCHEMBL28264169 | 0.77 | CYP3A4 (0.44) | CYP3A4CASP1RECQLPBRM1NPSR1 | |
| SCHEMBL4798849 | 0.73 | NPSR1 (0.52) | CYP3A4RECQLNPSR1ALDH1A1TDP1 | |
| SCHEMBL27399052 | 0.73 | NPSR1 (0.47) | NPSR1ALDH1A1TDP1MCL1TSHR | |
| SCHEMBL15640887 | 0.70 | SIGMAR1 (0.47) | CYP3A4CASP1RECQLPBRM1NPSR1 | |
| SCHEMBL19778 | 0.70 | NPSR1 (0.70) | NPSR1ALDH1A1TDP1TSHRNPC1 | |
| Bicarbonate SCHEMBL10433487 | 0.70 | CYP3A4 (0.71) | CYP3A4CASP1RECQLPBRM1NPSR1 | |
| SCHEMBL27595783 | 0.69 | NPSR1 (0.34) | NPSR1 | |
| SCHEMBL8940246 | 0.69 | PBRM1 (0.56) | PBRM1NPSR1ALDH1A1HSD17B10NPC1 |
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-2001087852-A1 | SUBSTITUTED POLYCYCLIC ARYL AND HETEROARYL URACILS USEFUL FOR SELECTIVE INHIBITION OF THE COAGULATION CASCADE | PHARMACIA CORPORATION (US) | 2001-11-22 | — | — | WO | claimed |