Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL11667512 | 0.85 | LMNA (0.42) | LMNAPARP1KDM4EPOLBNPSR1 | |
| SCHEMBL28236178 | 0.81 | KDM4E (0.38) | KDM4EPOLBCYP1A2L3MBTL1ALDH1A1 | |
| SCHEMBL663628 | 0.77 | LMNA (0.44) | LMNAPARP1KDM4EPOLBNPSR1 | |
| SCHEMBL11390081 | 0.77 | CA12 (0.43) | KDM4EPOLBCYP1A2SMN1; SMN2L3MBTL1 | |
| SCHEMBL5706422 | 0.77 | OXER1 (0.47) | LMNAPARP1KDM4EPOLBNPSR1 | |
| SCHEMBL7462145 | 0.76 | KMT2A (0.41) | LMNAPARP1KDM4EPOLBNPSR1 | |
| SCHEMBL6428552 | 0.76 | PARP1 (0.48) | LMNAPARP1KDM4EPOLBNPSR1 | |
| SCHEMBL28147782 | 0.76 | LMNA (0.43) | LMNAPARP1KDM4EPOLBNPSR1 | |
| SCHEMBL28147868 | 0.76 | MTNR1A (0.44) | LMNAPARP1KDM4EPOLBNPSR1 | |
| SCHEMBL31219282 | 0.76 | PARP1 (0.48) | LMNAPARP1KDM4EPOLBNPSR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106928121-B | High-efficiency preparation method of 3-substituted-benzo five-membered heterocycle-2-carbonyl compound | 暨南大学 | 2020-05-12 | — | — | CN | claimed |
| CN-105732470-B | The high efficiency preparation method of 3- fluoro-indole-2-carbonyl compound | 暨南大学 | 2018-07-31 | — | — | CN | claimed |
| CN-106928121-B | High-efficiency preparation method of 3-substituted-benzo five-membered heterocycle-2-carbonyl compound | 暨南大学 | 2020-05-12 | — | — | CN | disclosed |
| CN-105732470-B | The high efficiency preparation method of 3- fluoro-indole-2-carbonyl compound | 暨南大学 | 2018-07-31 | — | — | CN | disclosed |