Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTRB1 | P17538 | 1/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.38 |
| ▸ | PRKAG1 | P54619 | 4/20 | 0.38 |
| ▸ | PRKAB1 | Q9Y478 | 4/20 | 0.38 |
| ▸ | PRKAA2 | P54646 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PARK7 | Q99497 | 1/20 | 0.36 |
| ▸ | KDM5A | P29375 | 1/20 | 0.36 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.36 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 1/20 | 0.35 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL6666692 | 0.92 | PRKAG1 (0.45) | CTRB1PRKAG1PRKAB1PRKAA2HPGD | |
| SCHEMBL6663006 | 0.92 | PRKAG1 (0.40) | CTRB1PRKAG1PRKAB1PRKAA2HPGD | |
| SCHEMBL6670369 | 0.90 | PRKAG1 (0.43) | CTRB1PTGDR2PRKAG1PRKAB1PRKAA2 | |
| SCHEMBL6663894 | 0.89 | ALDH1A1 (0.45) | CTRB1PRKAG1PRKAB1PRKAA2HPGD | |
| SCHEMBL6665669 | 0.87 | CPT2 (0.43) | PTGDR2PRKAG1PRKAB1PRKAA2HPGD | |
| SCHEMBL6664683 | 0.87 | KMT2A (0.43) | CTRB1PRKAG1PRKAB1PRKAA2HPGD | |
| SCHEMBL6665427 | 0.84 | NNMT (0.43) | CTRB1PTGDR2PRKAG1PRKAB1PRKAA2 | |
| SCHEMBL6668468 | 0.79 | KDM5A (0.41) | CTRB1PTGDR2PRKAG1PRKAB1PRKAA2 | |
| SCHEMBL6665535 | 0.79 | KDM5A (0.41) | CTRB1PTGDR2PRKAG1PRKAB1PRKAA2 | |
| SCHEMBL6668559 | 0.77 | NNMT (0.41) | PTGDR2PRKAG1PRKAB1PRKAA2KDM5A |
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-2004014388-A1 | 6,6-FUSED HETEROARYL DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS | WARNER-LAMBERT COMPANY LLC (US) | 2004-02-19 | — | — | WO | disclosed |