Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.45 |
| ▸ | CA1 | P00915 | 4/20 | 0.45 |
| ▸ | CA2 | P00918 | 4/20 | 0.45 |
| ▸ | CA7 | P43166 | 4/20 | 0.45 |
| ▸ | CA9 | Q16790 | 4/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.45 |
| ▸ | CA5A | P35218 | 1/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | FASN | P49327 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 2/20 | 0.32 |
| ▸ | HCAR1 | Q9BXC0 | 3/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | XDH | P47989 | 1/20 | 0.31 |
| ▸ | GFER | P55789 | 1/20 | 0.31 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.31 |
| ▸ | RELA | Q04206 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9071926 | 0.85 | CA12 (0.60) | CA12CA1CA2CA7CA9 | |
| SCHEMBL3603403 | 0.80 | CA1 (0.73) | CA12CA1CA2CA7CA9 | |
| SCHEMBL6172739 | 0.77 | PARP1 (0.48) | CA12CA1CA2CA7CA9 | |
| SCHEMBL26586745 | 0.76 | CA12 (0.50) | CA12CA1CA2CA7CA9 | |
| SCHEMBL9988254 | 0.74 | CA12 (0.68) | CA12CA1CA2CA7CA9 | |
| SCHEMBL14022964 | 0.72 | HDAC1 (0.41) | MGLLLMNAPARP1 | |
| SCHEMBL26586852 | 0.71 | ESR1 (0.49) | CA12CA1CA2CA7CA9 | |
| SCHEMBL28833018 | 0.70 | KDM4E (0.61) | CA12CA1CA2CA7CA9 | |
| SCHEMBL21500817 | 0.69 | CA12 (0.47) | CA12CA1CA2CA7CA9 | |
| SCHEMBL21500814 | 0.69 | CA12 (0.42) | CA12CA1CA2CA7CA9 |
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-2185570-B1 | NOVEL ACTIVATORS OF GLUCOKINASE | METABASIS THERAPEUTICS INC (US) | 2014-03-19 | — | — | EP | disclosed |