Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | GLA | P06280 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | HTR3A | P46098 | 1/20 | 0.36 |
| ▸ | STAT3 | P40763 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | TOP2A | P11388 | 1/20 | 0.36 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.36 |
| ▸ | NQO2 | P16083 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5841011 | 0.82 | TDP1 (0.55) | TDP1ALDH1A1HPGDGLAMAPT | |
| SCHEMBL6786144 | 0.79 | TDP1 (0.56) | TDP1ALDH1A1HPGDGLAMAPT | |
| SCHEMBL28244714 | 0.78 | ALDH1A1 (0.48) | TDP1ALDH1A1HPGDGLAMAPT | |
| SCHEMBL31123709 | 0.77 | TLR8 (0.49) | ALDH1A1HPGDGLAMAPTACHE | |
| SCHEMBL2178320 | 0.77 | EGFR (0.53) | TDP1ALDH1A1HPGDGLAMAPT | |
| SCHEMBL28035883 | 0.74 | TDP1 (0.59) | TDP1ALDH1A1HPGDGLAMAPT | |
| SCHEMBL30511098 | 0.73 | TDP1 (0.63) | TDP1ALDH1A1HPGDGLAMAPT | |
| SCHEMBL2596089 | 0.73 | TDP1 (0.63) | TDP1ALDH1A1HPGDGLAMAPT | |
| SCHEMBL7557514 | 0.71 | CYP2A6 (0.42) | TDP1ALDH1A1HPGDMAPTKDM4E | |
| SCHEMBL667881 | 0.69 | ALDH1A1 (0.59) | TDP1ALDH1A1HPGDGLAMAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116217478-A | Synthesis method of 6-amino-3-difluoromethyl quinoline | 苏州康润医药有限公司 | 2023-06-06 | — | — | CN | claimed |
| CN-116217478-A | Synthesis method of 6-amino-3-difluoromethyl quinoline | 苏州康润医药有限公司 | 2023-06-06 | — | — | CN | disclosed |
| CN-116217478-A | Synthesis method of 6-amino-3-difluoromethyl quinoline | 苏州康润医药有限公司 | 2023-06-06 | — | — | CN | disclosed |