Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.64 |
| ▸ | DRD2 | P14416 | 1/20 | 0.48 |
| ▸ | DRD4 | P21917 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 1/20 | 0.48 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.43 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.42 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.42 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14939688 | 0.91 | NPSR1 (0.77) | NPSR1DRD2DRD4DRD3LMNA | |
| SCHEMBL14939243 | 0.90 | NPSR1 (0.65) | NPSR1ALDH1A1KDM4EOPRL1LMNA | |
| SCHEMBL14939115 | 0.88 | NPSR1 (0.60) | NPSR1TRPV6CHRM2CHRM3ALDH1A1 | |
| SCHEMBL14939690 | 0.84 | NPSR1 (0.77) | NPSR1TRPV6CHRM2CHRM3ALDH1A1 | |
| SCHEMBL14939318 | 0.82 | NPSR1 (0.60) | NPSR1DRD2DRD4DRD3TRPV6 | |
| SCHEMBL14939436 | 0.81 | NPSR1 (0.61) | NPSR1CHRM2CHRM3ALDH1A1KDM4E | |
| SCHEMBL14940290 | 0.80 | NPSR1 (0.63) | NPSR1DRD2TRPV6CHRM2CHRM3 | |
| SCHEMBL14939617 | 0.79 | NPSR1 (1.00) | NPSR1DRD2LMNAMAPTMMP2 | |
| SCHEMBL14939390 | 0.79 | NPSR1 (0.75) | NPSR1DRD2OPRM1LMNAMAPT | |
| SCHEMBL14939299 | 0.79 | NPSR1 (0.58) | NPSR1ALDH1A1KDM4EP2RX7LMNA |
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 |