Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 2/20 | 0.47 |
| ▸ | KIF11 | P52732 | 6/20 | 0.42 |
| ▸ | TRPV6 | Q9H1D0 | 2/20 | 0.42 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.42 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.42 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | PRF1 | P14222 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | WRN | Q14191 | 1/20 | 0.38 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.36 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | APP | P05067 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL28524259 | 0.85 | MGLL (0.50) | MGLLKIF11PRF1HSD17B2HSD17B1 | |
| SCHEMBL14705447 | 0.80 | KIF11 (0.52) | KIF11PRF1TSHRHSD17B2HSD17B1 | |
| SCHEMBL27961778 | 0.80 | KIF11 (0.52) | KIF11PRF1TSHRHSD17B2HSD17B1 | |
| SCHEMBL2556281 | 0.79 | HSD17B1 (0.49) | TRPV6ORAI1ORAI2ORAI3TSHR | |
| SCHEMBL14705469 | 0.78 | KIF11 (0.50) | KIF11PRF1WRNHSD17B2HSD17B1 | |
| SCHEMBL25165734 | 0.77 | KIF11 (0.54) | KIF11CA1CA2PRF1HSD17B2 | |
| SCHEMBL2558370 | 0.76 | HSD17B1 (0.42) | TRPV6ORAI1ORAI2ORAI3CA2 | |
| SCHEMBL28606077 | 0.76 | HDAC3 (0.47) | PRF1TSHRHSD17B2HSD17B1ESR1 | |
| SCHEMBL2556652 | 0.76 | TSHR (0.52) | PRF1TSHRHSD17B1ESR1APP | |
| SCHEMBL28527720 | 0.75 | HSD17B1 (0.62) | PRF1HSD17B2HSD17B1ESR1ESR2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108602834-B | Bruton's tyrosine kinase inhibitor | 北京盛诺基医药科技股份有限公司 | 2021-01-08 | — | — | CN | disclosed |