Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 4/20 | 0.60 |
| ▸ | CA12 | O43570 | 1/20 | 0.58 |
| ▸ | CA1 | P00915 | 1/20 | 0.58 |
| ▸ | CA2 | P00918 | 1/20 | 0.58 |
| ▸ | CA7 | P43166 | 1/20 | 0.58 |
| ▸ | CA9 | Q16790 | 1/20 | 0.58 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.53 |
| ▸ | MGLL | Q99685 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL17397027 | 0.89 | HSD11B1 (0.53) | HSD11B1CA12CA1CA2CA7 | |
| SCHEMBL6985975 | 0.88 | CA12 (0.71) | HSD11B1CA12CA1CA2CA7 | |
| SCHEMBL22305103 | 0.88 | CA12 (0.71) | HSD11B1CA12CA1CA2CA7 | |
| SCHEMBL643480 | 0.84 | ALDH1A1 (0.69) | HSD11B1CA12CA1CA2CA7 | |
| SCHEMBL31334408 | 0.84 | HPGD (0.76) | HSD11B1CA12CA1CA2CA7 | |
| SCHEMBL3355334 | 0.82 | HPGD (0.80) | HSD11B1CA12CA1CA2CA7 | |
| SCHEMBL7403944 | 0.82 | HPGD (0.55) | L3MBTL1ALDH1A1POLBHPGDMGLL | |
| Hydrochloric Acid SCHEMBL5337680 | 0.82 | ALDH1A1 (0.67) | HSD11B1CA12CA1CA2CA7 | |
| SCHEMBL18867940 | 0.82 | HPGD (0.80) | HSD11B1CA12CA1CA2CA7 | |
| SCHEMBL23832631 | 0.81 | CA12 (0.60) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112370452-A | Heterocyclic amides as kinase inhibitors | 葛兰素史密斯克莱知识产权发展有限公司 | 2021-02-19 | — | — | CN | disclosed |
| CN-107624111-B | Heterocyclic amides as kinase inhibitors | 葛兰素史密斯克莱知识产权发展有限公司 | 2020-11-03 | — | — | CN | disclosed |