Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 4/20 | 0.45 |
| ▸ | NOS1 | P29475 | 4/20 | 0.45 |
| ▸ | NOS2 | P35228 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7942881 | 0.80 | — | — | |
| SCHEMBL7625066 | 0.67 | NOS3 (0.43) | NOS3NOS1NOS2KMT2ACA1 | |
| SCHEMBL14777372 | 0.64 | INMT (0.48) | NOS3NOS1NOS2KMT2A | |
| SCHEMBL22039714 | 0.64 | NOS3 (0.43) | NOS3NOS1NOS2KMT2AGAA | |
| SCHEMBL22039567 | 0.64 | NOS3 (0.43) | NOS3NOS1NOS2KMT2AGAA | |
| SCHEMBL11806896 | 0.64 | — | — | |
| SCHEMBL8401014 | 0.62 | — | — | |
| SCHEMBL14668945 | 0.62 | — | — | |
| SCHEMBL9833413 | 0.60 | KMT2A (0.48) | KMT2ACA1CA2CA4GAA | |
| Hydrochloric Acid SCHEMBL19667261 | 0.60 | — | — |
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-3233831-B1 | NOVEL FXR (NR1H4) MODULATING COMPOUNDS | GILEAD SCIENCES INC (US) | 2019-02-20 | — | — | EP | disclosed |