Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.32 |
| ▸ | APEX1 | P27695 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1103817 | 0.68 | ALDH1A1 (0.40) | CYP1A2ALDH1A1KDM4EMAPTMEN1 | |
| SCHEMBL9772348 | 0.67 | PRKCI (0.45) | ALDH1A1KDM4EMAPTL3MBTL1MEN1 | |
| SCHEMBL6760708 | 0.65 | — | — | |
| SCHEMBL15228318 | 0.65 | CYP1A2 (0.40) | CYP1A2ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL11604949 | 0.65 | KDM4E (0.71) | CYP1A2ALDH1A1KDM4EMAPTL3MBTL1 | |
| SCHEMBL15150619 | 0.61 | ALDH1A1 (0.53) | CYP1A2ALDH1A1KDM4EPOLBSMN1; SMN2 | |
| SCHEMBL18927854 | 0.60 | CYP1A2 (0.44) | CYP1A2ALDH1A1KDM4EMAPTL3MBTL1 | |
| SCHEMBL11489947 | 0.59 | PRKCI (0.39) | ALDH1A1KDM4EMAPTL3MBTL1MEN1 | |
| SCHEMBL26558903 | 0.59 | CYP1A2 (0.39) | CYP1A2ALDH1A1CSNK2A1SMN1; SMN2ADORA2B | |
| SCHEMBL9093914 | 0.56 | KDM4E (0.33) | ALDH1A1KDM4EMAPTL3MBTL1MEN1 |
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-1791575-A | Cyanofluoropyrrolidine derivative. | TAISHO PHARMACEUTICAL CO LTD (JP) | 2006-06-21 | — | — | CN | disclosed |