Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.65 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.43 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 2/20 | 0.42 |
| ▸ | HTR2A | P28223 | 2/20 | 0.42 |
| ▸ | HTR2C | P28335 | 2/20 | 0.42 |
| ▸ | HTR2B | P41595 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL14940076 | 0.85 | NPSR1 (0.46) | NPSR1GRIN2BKMT2ALMNAMAPT | |
| SCHEMBL14939887 | 0.85 | NPSR1 (0.64) | NPSR1SIGMAR1MMP2MMP9DRD2 | |
| SCHEMBL14940429 | 0.84 | NPSR1 (0.46) | NPSR1GRIN2BKMT2AKDM4EALDH1A1 | |
| SCHEMBL14939501 | 0.84 | HTR1A (0.49) | NPSR1SIGMAR1DRD2HTR2BKDM4E | |
| SCHEMBL14940072 | 0.83 | L3MBTL1 (0.52) | NPSR1KMT2ADRD2HTR2BKDM4E | |
| SCHEMBL14939426 | 0.82 | NPSR1 (0.67) | NPSR1KMT2ASIGMAR1MMP2MMP9 | |
| SCHEMBL14940084 | 0.82 | MEN1 (0.47) | NPSR1KMT2ADRD2HTR2BKDM4E | |
| SCHEMBL14939341 | 0.81 | NPSR1 (0.65) | NPSR1KMT2ASIGMAR1MMP2MMP9 | |
| SCHEMBL14939259 | 0.81 | NPSR1 (0.65) | NPSR1SIGMAR1MMP2MMP9DRD2 | |
| SCHEMBL14939647 | 0.80 | NPSR1 (0.74) | NPSR1KMT2ASIGMAR1MMP2MMP9 |
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 |