Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ALPL | P05186 | 1/20 | 0.32 |
| ▸ | AGBL2 | Q5U5Z8 | 1/20 | 0.31 |
| ▸ | CDK8 | P49336 | 1/20 | 0.31 |
| ▸ | GSK3A | P49840 | 1/20 | 0.31 |
| ▸ | GSK3B | P49841 | 1/20 | 0.31 |
| ▸ | CDK9 | P50750 | 1/20 | 0.31 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.31 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.31 |
| ▸ | BACE1 | P56817 | 2/20 | 0.31 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.30 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28453095 | 0.80 | AGBL2 (0.39) | HTTAGBL2PIK3C3SSTR4 | |
| SCHEMBL107626 | 0.69 | BACE1 (0.42) | HTTGAAALPLAGBL2BACE1 | |
| SCHEMBL29570161 | 0.67 | CES2 (0.39) | HTTGAAALPLLMNA | |
| SCHEMBL28058122 | 0.67 | GAA (0.38) | HTTMEN1GAAKMT2ABACE1 | |
| SCHEMBL27861418 | 0.67 | TSHR (0.34) | MEN1CYP3A4GAAKMT2ACDK8 | |
| SCHEMBL27812260 | 0.66 | GRM5 (0.31) | MEN1CYP1A2CYP3A4GAACYP2C19 | |
| SCHEMBL27819606 | 0.66 | GRM5 (0.39) | MEN1CYP1A2CYP3A4GAACYP2C19 | |
| SCHEMBL27840502 | 0.66 | P2RX7 (0.34) | — | |
| SCHEMBL9363725 | 0.65 | P2RX7 (0.32) | — | |
| SCHEMBL9037566 | 0.65 | ALDH1A1 (0.39) | MEN1KMT2A |
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-103936717-B | A kind of delafloxacin intermediate and preparation method thereof | 上海医药工业研究院 | 2016-08-10 | — | — | CN | disclosed |