Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSR | P00390 | 2/20 | 0.46 |
| ▸ | NOS2 | P35228 | 6/20 | 0.45 |
| ▸ | NOS1 | P29475 | 5/20 | 0.45 |
| ▸ | NOS3 | P29474 | 4/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | BHMT | Q93088 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ARG2 | P78540 | 4/20 | 0.42 |
| ▸ | ARG1 | P05089 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | EYA2 | O00167 | 1/20 | 0.41 |
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | ACE | P12821 | 1/20 | 0.41 |
| ▸ | GRM8 | O00222 | 1/20 | 0.40 |
| ▸ | GRM6 | O15303 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2305699 | 0.92 | GSR (0.53) | GSRNOS2NOS1NOS3CYP1A2 | |
| SCHEMBL158633 | 0.92 | GSR (0.53) | GSRNOS2NOS1NOS3CYP1A2 | |
| SCHEMBL7166178 | 0.90 | GSR (0.52) | GSRNOS2NOS1NOS3CYP1A2 | |
| SCHEMBL10088294 | 0.90 | GSR (0.52) | GSRNOS2NOS1NOS3CYP1A2 | |
| Water SCHEMBL1336386 | 0.90 | GSR (0.52) | GSRNOS2NOS1NOS3CYP1A2 | |
| SCHEMBL5613110 | 0.88 | TDP1 (0.50) | GSRNOS2NOS1NOS3CYP1A2 | |
| SCHEMBL10088295 | 0.86 | NOS2 (0.51) | GSRNOS2NOS1NOS3CYP1A2 | |
| SCHEMBL13233386 | 0.85 | GSR (0.47) | GSRNOS2NOS1NOS3CYP1A2 | |
| SCHEMBL13541453 | 0.82 | TDP1 (0.59) | TSHRBLMCYP2C19TDP1EYA2 | |
| SCHEMBL11579726 | 0.79 | GSR (0.55) | GSRNOS2NOS1NOS3CYP1A2 |
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-2706057-B1 | Bis(imidazolyl)compounds and radionuclide complexes | MOLECULAR INSIGHT PHARM INC (US) | 2016-04-20 | — | — | EP | disclosed |