Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.72 |
| ▸ | MAPT | P10636 | 1/20 | 0.64 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.50 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | FAAH | O00519 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | DRD4 | P21917 | 1/20 | 0.45 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.45 |
| ▸ | TRPV5 | Q9NQA5 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL14939093 | 0.87 | MAPT (0.57) | NPSR1MAPTOPRL1CHRM3KDM4E | |
| SCHEMBL14940064 | 0.85 | MAPT (0.52) | NPSR1MAPTOPRL1LMNAKDM4E | |
| SCHEMBL14939190 | 0.85 | MAPT (0.57) | NPSR1MAPTOPRL1LMNAKDM4E | |
| SCHEMBL14939709 | 0.85 | NPSR1 (0.77) | NPSR1MAPTCHRM3LMNAALDH1A1 | |
| SCHEMBL14939617 | 0.84 | NPSR1 (1.00) | NPSR1MAPTLMNASIGMAR1 | |
| SCHEMBL14939425 | 0.84 | NPSR1 (0.79) | NPSR1MAPTCHRM3LMNAKDM4E | |
| SCHEMBL14939266 | 0.83 | MAPT (0.55) | NPSR1MAPTOPRL1CHRM3KDM4E | |
| SCHEMBL14939840 | 0.83 | NPSR1 (0.77) | NPSR1MAPTLMNAKDM4EKMT2A | |
| SCHEMBL14939933 | 0.83 | NPSR1 (0.77) | NPSR1MAPTCHRM3LMNAKDM4E | |
| SCHEMBL14940042 | 0.83 | MAPT (0.54) | NPSR1MAPTCHRM3LMNAKDM4E |
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 |