Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 2/20 | 0.46 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 4/20 | 0.44 |
| ▸ | CA2 | P00918 | 4/20 | 0.44 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | MGLL | Q99685 | 2/20 | 0.40 |
| ▸ | EDNRB | P24530 | 1/20 | 0.39 |
| ▸ | EDNRA | P25101 | 1/20 | 0.39 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.39 |
| ▸ | PLG | P00747 | 1/20 | 0.38 |
| ▸ | F12 | P00748 | 1/20 | 0.38 |
| ▸ | F11 | P03951 | 1/20 | 0.38 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.38 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.38 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.38 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28397051 | 0.94 | CA1 (0.49) | MCL1ACMSDCA1CA2CA12 | |
| SCHEMBL28415943 | 0.92 | CA1 (0.47) | MCL1ACMSDCA1CA2CA12 | |
| SCHEMBL2165047 | 0.86 | CA1 (0.59) | MCL1ACMSDCA1CA2CA12 | |
| SCHEMBL20124391 | 0.85 | MCL1 (0.53) | MCL1ACMSDCA1CA2CA12 | |
| SCHEMBL29610130 | 0.83 | MGLL (0.58) | MCL1ACMSDCA1CA2CA12 | |
| SCHEMBL622947 | 0.83 | MGLL (0.58) | MCL1ACMSDCA1CA2CA12 | |
| SCHEMBL29384733 | 0.83 | CA1 (0.52) | MCL1ACMSDCA1CA2CA12 | |
| SCHEMBL431998 | 0.83 | CA1 (0.52) | MCL1ACMSDCA1CA2CA12 | |
| SCHEMBL31277618 | 0.83 | MGLL (0.53) | MCL1ACMSDCA1CA2CA12 | |
| SCHEMBL26654156 | 0.83 | MGLL (0.53) | MCL1ACMSDCA1CA2CA12 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106554323-B | Phenazine group-substituted polycyclic aromatic hydrocarbon derivative and application thereof | 北京鼎材科技有限公司 | 2020-07-03 | — | — | CN | disclosed |