Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 3/20 | 0.45 |
| ▸ | CA9 | Q16790 | 3/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.45 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | PRKDC | P78527 | 2/20 | 0.38 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.38 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.38 |
| ▸ | SORD | Q00796 | 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 | |
|---|---|---|---|---|
| SCHEMBL5396825 | 0.77 | NQO1 (0.67) | NQO1CA12CA9CA1ALDH1A1 | |
| SCHEMBL27900521 | 0.76 | MAOA (0.36) | NQO1ALDH1A1KMT2AMEN1MAOA | |
| SCHEMBL3098964 | 0.73 | GPR35 (0.58) | CA9ALDH1A1KMT2AMEN1TP53 | |
| SCHEMBL11711318 | 0.71 | GAA (0.51) | ALDH1A1KMT2AMEN1LMNAKDM4E | |
| SCHEMBL31264770 | 0.71 | CA9 (0.68) | NQO1CA12CA9CA1ALDH1A1 | |
| SCHEMBL516275 | 0.71 | CA9 (0.68) | NQO1CA12CA9CA1ALDH1A1 | |
| SCHEMBL11499675 | 0.70 | CLK4 (0.42) | NQO1CA12CA9CA1ALDH1A1 | |
| SCHEMBL29182639 | 0.70 | CA9 (0.54) | NQO1CA12CA9CA1ALDH1A1 | |
| SCHEMBL28124980 | 0.70 | MAOB (0.61) | NQO1CA12CA9CA1ALDH1A1 | |
| SCHEMBL2197897 | 0.69 | ALDH1A1 (0.38) | ALDH1A1KMT2AMEN1TP53MAOA |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102746281-A | 4-1,2,3-triazole-coumarin derivative and its preparation method and application | UNIV SICHUAN | 2012-10-24 | — | — | CN | claimed |
| CN-102746281-B | 4-1,2,3-triazole-coumarin derivative and its preparation method and application | UNIV SICHUAN | 2015-01-14 | — | — | CN | disclosed |
| CN-102746281-B | 4-1,2,3-triazole-coumarin derivative and its preparation method and application | UNIV SICHUAN | 2015-01-14 | — | — | CN | disclosed |
| CN-102746281-B | 4-1,2,3-triazole-coumarin derivative and its preparation method and application | UNIV SICHUAN | 2015-01-14 | — | — | CN | disclosed |
| CN-102746281-A | 4-1,2,3-triazole-coumarin derivative and its preparation method and application | UNIV SICHUAN | 2012-10-24 | — | — | CN | disclosed |
| CN-102746281-A | 4-1,2,3-triazole-coumarin derivative and its preparation method and application | UNIV SICHUAN | 2012-10-24 | — | — | CN | disclosed |
| CN-102746281-A | 4-1,2,3-triazole-coumarin derivative and its preparation method and application | UNIV SICHUAN | 2012-10-24 | — | — | CN | disclosed |