Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.35 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.35 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.35 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | NQO2 | P16083 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA4 | P22748 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28288993 | 0.86 | KMT2A (0.41) | ALDH1A1TDP1CYP1A2SMN1; SMN2KMT2A | |
| SCHEMBL28290486 | 0.82 | LMNA (0.34) | CYP1A2RAB9ATSHRHTTMAPT | |
| SCHEMBL28289057 | 0.81 | ALDH1A1 (0.46) | ALDH1A1TDP1CYP1A2SMN1; SMN2KMT2A | |
| SCHEMBL25263151 | 0.78 | ALDH1A1 (0.44) | ALDH1A1TDP1CYP1A2KMT2ATSHR | |
| SCHEMBL28693816 | 0.78 | ALDH1A1 (0.43) | ALDH1A1TDP1CYP1A2KMT2ARAB9A | |
| SCHEMBL19742720 | 0.77 | NQO2 (0.47) | ALDH1A1CYP1A2SMN1; SMN2KMT2ARAB9A | |
| SCHEMBL30279945 | 0.75 | ALDH1A1 (0.37) | ALDH1A1TDP1CYP1A2SMN1; SMN2KMT2A | |
| SCHEMBL28697184 | 0.74 | HSP90AA1 (0.45) | ALDH1A1TDP1CYP1A2SMN1; SMN2KMT2A | |
| SCHEMBL19753977 | 0.74 | NQO2 (0.45) | ALDH1A1SMN1; SMN2KMT2ARAB9AGLA | |
| SCHEMBL19742430 | 0.73 | GPR35 (0.50) | ALDH1A1TDP1SMN1; SMN2KMT2ATSHR |
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-109562111-A | CK2 inhibitor, its composition and method | 北极星药业股份有限公司 | 2019-04-02 | — | — | CN | disclosed |