Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 6/20 | 0.49 |
| ▸ | CA1 | P00915 | 5/20 | 0.49 |
| ▸ | CA9 | Q16790 | 3/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | COMT | P21964 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL785066 | 0.90 | CA2 (0.46) | CA2CA1CA9MAPK1FTO | |
| SCHEMBL3448835 | 0.86 | CA2 (0.51) | CA2CA1CA9MAPK1FTO | |
| SCHEMBL28094137 | 0.83 | CA1 (0.49) | CA2CA1CA9MAPK1FTO | |
| SCHEMBL2852456 | 0.80 | CA1 (0.53) | CA2CA1CA9MAPK1FTO | |
| SCHEMBL28129506 | 0.78 | CA1 (0.47) | CA2CA1CA9MAPK1FTO | |
| SCHEMBL28094337 | 0.76 | CA1 (0.43) | CA2CA1CA9MAPK1FTO | |
| SCHEMBL28094527 | 0.76 | CA1 (0.43) | CA2CA1CA9MAPK1FTO | |
| SCHEMBL27801396 | 0.75 | CA2 (0.47) | CA2CA1CA9MAPK1FTO | |
| SCHEMBL28125833 | 0.75 | CA1 (0.47) | CA2CA1CA9MAPK1FTO | |
| SCHEMBL4931688 | 0.74 | COMT (0.51) | CA2CA1CA9MAPK1FTO |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108884046-A | chemical compounds as inhibitors of kinase activity | 葛兰素史克知识产权开发有限公司 | 2018-11-23 | — | — | CN | claimed |
| EP-3414228-A1 | CHEMICAL COMPOUNDS AS INHIBITORS OF KINASE ACTIVITY | GlaxoSmithKline Intellectual Property Development Limited (GB) | 2018-12-19 | — | — | EP | disclosed |
| CN-108884046-A | chemical compounds as inhibitors of kinase activity | 葛兰素史克知识产权开发有限公司 | 2018-11-23 | — | — | CN | disclosed |
| WO-2017137535-A1 | CHEMICAL COMPOUNDS AS INHIBITORS OF KINASE ACTIVITY | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2017-08-17 | — | — | WO | disclosed |