Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 13/20 | 0.52 |
| ▸ | CA9 | Q16790 | 12/20 | 0.52 |
| ▸ | CA2 | P00918 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | ELANE | P08246 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL12601260 | 0.86 | CA12 (0.56) | CA12CA9CA2KMT2ATDP1 | |
| SCHEMBL13632922 | 0.86 | CA12 (0.56) | CA12CA9CA2KMT2ATDP1 | |
| SCHEMBL8282041 | 0.78 | TPSAB1 (0.54) | CA12CA9CA2KMT2ATDP1 | |
| SCHEMBL13622671 | 0.78 | TPSAB1 (0.54) | CA12CA9CA2KMT2ATDP1 | |
| SCHEMBL8282960 | 0.78 | CA12 (0.59) | CA12CA9CA2KMT2ATDP1 | |
| SCHEMBL26232554 | 0.75 | CA12 (0.68) | CA12CA9CA2KMT2AELANE | |
| SCHEMBL18026643 | 0.72 | CA12 (0.68) | CA12CA9CA2KMT2ATDP1 | |
| SCHEMBL8970514 | 0.70 | CA12 (0.65) | CA12CA9CA2ELANEALDH1A1 | |
| SCHEMBL1101896 | 0.70 | CA12 (1.00) | CA12CA9CA2ELANEALDH1A1 | |
| SCHEMBL30834902 | 0.70 | CA12 (1.00) | CA12CA9CA2ELANEALDH1A1 |
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-1730142-B1 | NOVEL KETOAMIDES WITH CYCLIC P4'S AS INHIBITORS OF NS3 SERINE PROTEASE OF HEPATITIS C VIRUS | SCHERING CORP (US) | 2011-06-29 | — | — | EP | disclosed |