Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | TACR1 | P25103 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CASP7 | P55210 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | HRH2 | P25021 | 1/20 | 0.41 |
| ▸ | HRH1 | P35367 | 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 | |
|---|---|---|---|---|
| SCHEMBL14939276 | 0.91 | NPSR1 (0.59) | NPSR1KMT2ATACR1TP53KDM4E | |
| SCHEMBL14938988 | 0.90 | KDM4E (0.52) | NPSR1KMT2ATP53KDM4ETSHR | |
| SCHEMBL14939990 | 0.89 | KDM4E (0.51) | NPSR1KMT2ATACR1TP53KDM4E | |
| SCHEMBL14939842 | 0.89 | NPSR1 (0.50) | NPSR1KMT2ATP53KDM4EMAPT | |
| SCHEMBL14939401 | 0.89 | NPSR1 (0.50) | NPSR1KMT2ATP53KDM4EMAPT | |
| SCHEMBL14939859 | 0.87 | TP53 (0.49) | NPSR1KMT2ATP53KDM4ETSHR | |
| SCHEMBL14939141 | 0.86 | HTR7 (0.44) | NPSR1KMT2ATACR1TP53KDM4E | |
| SCHEMBL14939948 | 0.85 | NPSR1 (0.48) | NPSR1KMT2ATP53KDM4EMAPT | |
| SCHEMBL14939857 | 0.85 | NPSR1 (0.48) | NPSR1KMT2ATP53KDM4EMAPT | |
| SCHEMBL14939609 | 0.84 | NPSR1 (0.52) | NPSR1KMT2ATP53TSHRCYP2D6 |
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 |