Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | CA7 | P43166 | 1/20 | 0.51 |
| ▸ | CA9 | Q16790 | 1/20 | 0.51 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.51 |
| ▸ | PARP10 | Q53GL7 | 6/20 | 0.47 |
| ▸ | PARP15 | Q460N3 | 5/20 | 0.47 |
| ▸ | F2 | P00734 | 1/20 | 0.44 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.43 |
| ▸ | KAT6A | Q92794 | 3/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | GCK | P35557 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.39 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.39 |
| ▸ | CDK1 | P06493 | 1/20 | 0.39 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.39 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10068809 | 0.85 | PARP15 (0.49) | CA12CA1CA2CA7CA9 | |
| SCHEMBL23206842 | 0.84 | PARP15 (0.48) | PARP10PARP15F2PARP2ATM | |
| SCHEMBL4569150 | 0.84 | PARP10 (0.50) | PARP10PARP15PARP2KAT6AGCK | |
| SCHEMBL14813011 | 0.81 | WDR5 (0.48) | CA1CA2PARP10PARP15F2 | |
| SCHEMBL20897525 | 0.81 | NR1H4 (0.54) | PARP10PARP15KAT6AADAM17 | |
| SCHEMBL21817404 | 0.80 | KAT6A (0.52) | PARP10PARP15F2PARP2KAT6A | |
| SCHEMBL10068810 | 0.80 | NR1H4 (0.50) | PARP10PARP15F2PARP2KAT6A | |
| SCHEMBL30056075 | 0.80 | KAT6A (0.52) | PARP10PARP15F2PARP2KAT6A | |
| SCHEMBL15054264 | 0.80 | CYP19A1 (0.46) | PARP10PARP15KMT2A | |
| SCHEMBL4569155 | 0.80 | PARP10 (0.48) | PARP10PARP15PARP2KAT6AGCK |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016112863-A1 | N-SUBSTITUTED-3,5-DISUBSTITUTED BENZAMIDE COMPOUND AND PREPARATION METHOD AND APPLICATION THEREOF | 中国科学院上海药物研究所 | 2016-07-21 | — | — | WO | disclosed |