Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.64 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | GALR3 | O60755 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | DOCK5 | Q9H7D0 | 1/20 | 0.45 |
| ▸ | HTR7 | P34969 | 2/20 | 0.45 |
| ▸ | DRD4 | P21917 | 1/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | CASP7 | P55210 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL14939838 | 0.87 | NPSR1 (0.73) | NPSR1MAPTALDH1A1SIGMAR1LMNA | |
| SCHEMBL14939942 | 0.86 | NPSR1 (0.68) | NPSR1MAPTKMT2AALDH1A1HTR7 | |
| SCHEMBL14939276 | 0.84 | NPSR1 (0.59) | NPSR1MAPTKMT2AALDH1A1DRD4 | |
| SCHEMBL14940106 | 0.82 | NPSR1 (0.72) | NPSR1MAPTKMT2AALDH1A1SIGMAR1 | |
| SCHEMBL14939954 | 0.81 | NPSR1 (0.82) | NPSR1MAPTKMT2ASIGMAR1MEN1 | |
| SCHEMBL14939947 | 0.80 | NPSR1 (0.77) | NPSR1MAPTKMT2AALDH1A1SIGMAR1 | |
| SCHEMBL14939174 | 0.80 | NPSR1 (0.65) | NPSR1MAPTKMT2AALDH1A1HTR7 | |
| SCHEMBL14939350 | 0.79 | NPSR1 (0.58) | NPSR1MAPTKMT2AALDH1A1SIGMAR1 | |
| SCHEMBL14939617 | 0.79 | NPSR1 (1.00) | NPSR1MAPTSIGMAR1LMNA | |
| SCHEMBL14939167 | 0.79 | NPSR1 (0.70) | NPSR1MAPTKMT2AALDH1A1HTR7 |
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 |