Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | CCR8 | P51685 | 2/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | FABP6 | P51161 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14939244 | 0.90 | NPSR1 (0.71) | NPSR1MAPTLMNATP53KMT2A | |
| SCHEMBL14939517 | 0.89 | NPSR1 (0.57) | NPSR1MAPTLMNATP53ALDH1A1 | |
| SCHEMBL14939499 | 0.87 | NPSR1 (0.55) | NPSR1MAPTLMNATP53ALDH1A1 | |
| SCHEMBL14939562 | 0.87 | NPSR1 (0.60) | NPSR1MAPTTP53ALDH1A1KDM4E | |
| SCHEMBL14938836 | 0.85 | NPSR1 (0.50) | NPSR1MAPTLMNATP53KMT2A | |
| SCHEMBL14939604 | 0.85 | NPSR1 (0.46) | NPSR1MAPTLMNAALDH1A1KDM4E | |
| SCHEMBL14939742 | 0.84 | NPSR1 (0.82) | NPSR1MAPTLMNAKDM4ECYP2D6 | |
| SCHEMBL14939879 | 0.84 | NPSR1 (0.53) | NPSR1MAPTLMNATP53KMT2A | |
| SCHEMBL14938722 | 0.84 | NPSR1 (0.53) | NPSR1MAPTLMNATP53ALDH1A1 | |
| SCHEMBL14939199 | 0.83 | NPSR1 (0.55) | NPSR1MAPTLMNATP53ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013068785-A1 | INDANONE AND INDANDIONE DERIVATIVES AND HETEROCYCLIC ANALOGS | ACTELION PHARMACEUTICALS LTD (CH) | 2013-05-16 | — | — | WO | claimed |
| WO-2013068785-A1 | INDANONE AND INDANDIONE DERIVATIVES AND HETEROCYCLIC ANALOGS | ACTELION PHARMACEUTICALS LTD (CH) | 2013-05-16 | — | — | WO | disclosed |