Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.47 |
| ▸ | NOS1 | P29475 | 1/20 | 0.47 |
| ▸ | NOS2 | P35228 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | PIKFYVE | Q9Y2I7 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.30 |
| ▸ | WNT3A | P56704 | 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 | |
|---|---|---|---|---|
| SCHEMBL3328642 | 0.84 | NOS3 (0.50) | NOS3NOS1NOS2HTR2BSIGMAR1 | |
| SCHEMBL8567874 | 0.81 | NOS3 (0.47) | NOS3NOS1NOS2HTR2BSIGMAR1 | |
| SCHEMBL3328921 | 0.80 | NOS3 (0.45) | NOS3NOS1NOS2HTR2BSIGMAR1 | |
| SCHEMBL14193412 | 0.77 | NOS3 (0.43) | NOS3NOS1NOS2HTR2B | |
| SCHEMBL23091837 | 0.76 | NOS3 (0.50) | NOS3NOS1NOS2HTR2BSIGMAR1 | |
| SCHEMBL29569615 | 0.76 | NOS3 (0.50) | NOS3NOS1NOS2HTR2BSIGMAR1 | |
| SCHEMBL10272934 | 0.76 | NOS3 (0.50) | NOS3NOS1NOS2HTR2BSIGMAR1 | |
| SCHEMBL25574578 | 0.76 | NOS3 (0.55) | NOS3NOS1NOS2HTR2BSIGMAR1 | |
| SCHEMBL25061140 | 0.74 | NOS3 (0.48) | NOS3NOS1NOS2HTR2BSIGMAR1 | |
| SCHEMBL24221641 | 0.74 | NOS3 (0.48) | NOS3NOS1NOS2HTR2BSIGMAR1 |
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-0824524-A1 | ALPHA-SUBSTITUTED PYRIMIDINE-THIOALKYL AND ALKYLETHER COMPOUNDS AS INHIBITORS OF VIRAL REVERSE TRANSCRIPTASE | PHARMACIA & UPJOHN COMPANY (US) | 1998-02-25 | — | — | EP | disclosed |