Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.46 |
| ▸ | PPARA | Q07869 | 2/20 | 0.43 |
| ▸ | CTSS | P25774 | 1/20 | 0.41 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.41 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 2/20 | 0.40 |
| ▸ | TACR1 | P25103 | 3/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | MMP14 | P50281 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8502030 | 0.90 | NPSR1 (0.47) | NPSR1L3MBTL1PPARACTSSNR1H2 | |
| SCHEMBL8936940 | 0.88 | TACR1 (0.57) | TACR1 | |
| SCHEMBL27422195 | 0.85 | NPSR1 (0.62) | NPSR1L3MBTL1PPARACTSSPPARG | |
| SCHEMBL30836091 | 0.84 | NPSR1 (0.51) | NPSR1L3MBTL1PPARACTSSPPARG | |
| SCHEMBL24325920 | 0.83 | SMN1; SMN2 (0.44) | NPSR1L3MBTL1CTSSBACE1MAPT | |
| SCHEMBL30836074 | 0.83 | NPSR1 (0.50) | NPSR1L3MBTL1PPARACTSSPPARG | |
| SCHEMBL30836087 | 0.83 | NPSR1 (0.49) | NPSR1L3MBTL1PPARACTSSPPARG | |
| SCHEMBL30836084 | 0.80 | NPSR1 (0.47) | NPSR1L3MBTL1PPARACTSSPPARG | |
| SCHEMBL30987151 | 0.78 | NPSR1 (0.51) | NPSR1L3MBTL1PPARACTSSBACE1 | |
| SCHEMBL948156 | 0.75 | L3MBTL1 (0.43) | NPSR1L3MBTL1CTSSMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5864045-A | Heterocyclic substituted piperazinone derivatives | HOECHST MARION ROUSSEL, INC. (US) | 1999-01-26 | — | — | US | disclosed |
| US-5840726-A | Heterocyclic substituted piperazinone derivatives | HOECHST MARION ROUSSEL INC. (US) | 1998-11-24 | — | — | US | disclosed |