Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APLNR | P35414 | 2/20 | 0.34 |
| ▸ | HTR2A | P28223 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.32 |
| ▸ | FEN1 | P39748 | 2/20 | 0.32 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.31 |
| ▸ | PDE2A | O00408 | 1/20 | 0.30 |
| ▸ | CA12 | O43570 | 2/20 | 0.30 |
| ▸ | CA1 | P00915 | 2/20 | 0.30 |
| ▸ | CA9 | Q16790 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16629287 | 1.00 | APLNR (0.34) | APLNRHTR2ASLC6A4KCNH2MEN1 | |
| SCHEMBL30856497 | 0.81 | HTR2A (0.32) | HTR2AKCNH2KMT2A | |
| SCHEMBL7438530 | 0.81 | HTR2A (0.32) | HTR2AKCNH2KMT2A | |
| SCHEMBL856992 | 0.77 | TRPA1 (0.41) | ALOX5APFEN1EPAS1 | |
| SCHEMBL1178694 | 0.76 | SLC6A4 (0.38) | SLC6A4DRD2ALOX5APFEN1CA12 | |
| SCHEMBL2591903 | 0.75 | ADRA2A (0.45) | HTR2ASLC6A4KCNH2MEN1KMT2A | |
| SCHEMBL2588953 | 0.75 | ADRA2A (0.45) | HTR2ASLC6A4KCNH2MEN1KMT2A | |
| SCHEMBL2592419 | 0.75 | ADRA2A (0.45) | HTR2ASLC6A4KCNH2MEN1KMT2A | |
| SCHEMBL1056366 | 0.75 | ALOX5AP (0.36) | APLNRALOX5APFEN1CA12CA1 | |
| SCHEMBL1178457 | 0.75 | DRD2 (0.38) | HTR2ASLC6A4KCNH2DRD2ALOX5AP |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015050989-A2 | MACROCYCLIC COMPOUNDS FOR THE TREATMENT OF PROLIFERATIVE DISEASES | CS THERAPEUTICS INC. (US) | 2015-04-09 | — | — | WO | disclosed |