Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.31 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.30 |
| ▸ | CYP4A11 | Q02928 | 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 | |
|---|---|---|---|---|
| SCHEMBL2044620 | 0.84 | NPSR1 (0.36) | NPSR1MEN1CYP3A4KMT2AUSP2 | |
| SCHEMBL18352400 | 0.84 | MEN1 (0.41) | NPSR1MEN1CYP3A4KMT2A | |
| SCHEMBL15214890 | 0.79 | NPSR1 (0.37) | NPSR1MEN1CYP3A4KMT2AUSP2 | |
| SCHEMBL12385681 | 0.79 | DPP4 (0.34) | NPSR1MEN1CYP3A4KMT2AUSP2 | |
| SCHEMBL15214887 | 0.78 | CYP3A4 (0.37) | NPSR1MEN1CYP3A4KMT2ACYP4F2 | |
| SCHEMBL3000664 | 0.77 | GRIN2B (0.40) | USP2 | |
| SCHEMBL3000663 | 0.77 | GRIN2B (0.40) | USP2 | |
| SCHEMBL10039817 | 0.77 | GRIN2B (0.40) | USP2 | |
| SCHEMBL12934881 | 0.76 | GAA (0.40) | — | |
| SCHEMBL23643970 | 0.76 | NPSR1 (0.38) | NPSR1MEN1CYP3A4KMT2AUSP2 |
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 |
|---|---|---|---|---|---|---|---|
| US-9914721-B2 | Use of benzimidazole-proline derivatives | IDORSIA PHARMACEUTICALS LTD (CH) | 2018-03-13 | — | — | US | disclosed |