Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14940020 | 0.95 | NPSR1 (0.51) | TP53NPSR1MAPTLMNAKDM4E | |
| SCHEMBL14939445 | 0.92 | TP53 (0.51) | TP53NPSR1MAPTLMNAKDM4E | |
| SCHEMBL14939539 | 0.90 | NPSR1 (0.55) | TP53NPSR1MAPTLMNAKDM4E | |
| SCHEMBL14939824 | 0.90 | NPSR1 (0.49) | TP53NPSR1MAPTALDH1A1KMT2A | |
| SCHEMBL14939490 | 0.90 | TP53 (0.47) | TP53NPSR1MAPTLMNAKDM4E | |
| SCHEMBL14939859 | 0.89 | TP53 (0.49) | TP53NPSR1MAPTLMNAKDM4E | |
| SCHEMBL14939577 | 0.89 | NPSR1 (0.52) | TP53NPSR1MAPTLMNAKDM4E | |
| SCHEMBL14939326 | 0.88 | NPSR1 (0.65) | TP53NPSR1MAPTLMNAKDM4E | |
| SCHEMBL14939001 | 0.87 | TP53 (0.60) | TP53NPSR1MAPTLMNAKDM4E | |
| SCHEMBL14939725 | 0.86 | TP53 (0.47) | TP53NPSR1MAPTLMNAKDM4E |
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 |