Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.41 |
| ▸ | CA9 | Q16790 | 4/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA3 | P07451 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | CA6 | P23280 | 1/20 | 0.41 |
| ▸ | CA5A | P35218 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.41 |
| ▸ | HCAR1 | Q9BXC0 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29611187 | 0.79 | KDM4E (0.48) | CA12CA9CA1CA3CA4 | |
| SCHEMBL22607244 | 0.79 | KDM4E (0.48) | CA12CA9CA1CA3CA4 | |
| SCHEMBL29871305 | 0.77 | CA12 (0.57) | CA12CA9CA1CA3CA4 | |
| SCHEMBL237720 | 0.77 | CA12 (0.57) | CA12CA9CA1CA3CA4 | |
| Hydrochloric Acid SCHEMBL31179088 | 0.76 | CA12 (0.55) | CA12CA9CA1CA3CA4 | |
| SCHEMBL30804611 | 0.76 | CA12 (0.55) | CA12CA9CA1CA3CA4 | |
| SCHEMBL1287815 | 0.75 | MCL1 (0.46) | ALDH1A1HPGDKDM4ESMN1; SMN2HTT | |
| SCHEMBL241747 | 0.74 | HPRT1 (0.54) | ALDH1A1KDM4ESMN1; SMN2KMT2ANPC1 | |
| SCHEMBL10528166 | 0.73 | HCAR2 (0.41) | CA12CA9CA1CA3CA4 | |
| SCHEMBL5313529 | 0.72 | KDM4E (0.48) | CA12CA9CA1CA3CA4 |
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-106243103-A | Naphtho-[1,2 h] [1,6] naphthyridines 3 (4H) ketone compounds and its preparation method and application | 广西师范大学 | 2016-12-21 | — | — | CN | claimed |
| CN-106243103-A | Naphtho-[1,2 h] [1,6] naphthyridines 3 (4H) ketone compounds and its preparation method and application | 广西师范大学 | 2016-12-21 | — | — | CN | disclosed |