Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14939310 | 0.87 | NPSR1 (0.46) | KDM4EALDH1A1NPSR1MEN1KMT2A | |
| SCHEMBL14939769 | 0.84 | NPSR1 (0.62) | KDM4EALDH1A1NPSR1BCHELMNA | |
| SCHEMBL14940079 | 0.83 | SIGMAR1 (0.50) | KDM4EALDH1A1NPSR1MEN1KMT2A | |
| SCHEMBL14939437 | 0.82 | ALDH1A1 (0.48) | KDM4EALDH1A1HTTNPSR1ALOX15 | |
| SCHEMBL14939271 | 0.80 | MEN1 (0.44) | KDM4EALDH1A1HTTNPSR1ALOX15 | |
| SCHEMBL14939762 | 0.80 | ALDH1A1 (0.45) | KDM4EALDH1A1HTTNPSR1BCHE | |
| SCHEMBL14939733 | 0.80 | NPSR1 (0.47) | KDM4EALDH1A1HTTNPSR1ALOX15 | |
| SCHEMBL14940084 | 0.79 | MEN1 (0.47) | KDM4EALDH1A1HTTNPSR1ALOX15 | |
| SCHEMBL14939174 | 0.79 | NPSR1 (0.65) | KDM4EALDH1A1NPSR1ALOX15MEN1 | |
| SCHEMBL14939088 | 0.79 | NPSR1 (0.46) | KDM4EALDH1A1HTTNPSR1MEN1 |
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 |