Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | EPAS1 | Q99814 | 5/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 2/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | VEGFA | P15692 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | PARP10 | Q53GL7 | 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 | |
|---|---|---|---|---|
| SCHEMBL16635252 | 0.83 | L3MBTL1 (0.49) | CYP1A2FFAR4FFAR1SLC6A4HTR1A | |
| SCHEMBL49837 | 0.76 | LMNA (0.54) | SLC6A4HTR1ASLC6A2SLC6A3ALDH1A1 | |
| SCHEMBL5536030 | 0.76 | CYP1A2 (0.40) | CYP1A2CYP2A6FFAR4FFAR1EPAS1 | |
| SCHEMBL22167329 | 0.76 | AR (0.49) | CYP1A2CYP2A6FFAR4FFAR1SLC6A4 | |
| SCHEMBL15903754 | 0.76 | NPSR1 (0.65) | CYP1A2EPAS1NPSR1ALDH1A1LMNA | |
| SCHEMBL2186316 | 0.75 | CA12 (0.38) | NPSR1ALDH1A1LMNAL3MBTL1 | |
| SCHEMBL9643385 | 0.72 | CXCL8 (0.50) | SLC6A4HTR1ASLC6A2SLC6A3ALDH1A1 | |
| SCHEMBL6727534 | 0.72 | FFAR4 (0.57) | FFAR4EPAS1VEGFA | |
| SCHEMBL13857956 | 0.72 | ENPP2 (0.50) | CYP1A2CYP2A6FFAR4FFAR1NPSR1 | |
| SCHEMBL28630155 | 0.72 | LTA4H (0.60) | CYP1A2CYP2A6FFAR4FFAR1SLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0246713-B1 | INTERMEDIATES FOR THE PRODUCTION OF NITROGEN-CONTAINING SUBSTITUTED HETEROCYCLIC COMPOUNDS | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1992-03-04 | — | — | EP | disclosed |