Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.53 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.49 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | FAAH | O00519 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | DRD4 | P21917 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL14940161 | 0.94 | TSHR (0.49) | TSHRNR1H4ALDH1A1ALDH3A1SIGMAR1 | |
| SCHEMBL14939192 | 0.91 | ALDH1A1 (0.49) | TSHRNR1H4ALDH1A1ALDH3A1SIGMAR1 | |
| SCHEMBL14939246 | 0.84 | NPSR1 (0.53) | SIGMAR1NPSR1DRD2 | |
| SCHEMBL14940051 | 0.84 | NPSR1 (0.53) | SIGMAR1NPSR1DRD2 | |
| SCHEMBL14939245 | 0.84 | NPSR1 (0.53) | SIGMAR1NPSR1DRD2 | |
| SCHEMBL14939923 | 0.83 | CXCR3 (0.61) | ALDH1A1SIGMAR1KMT2AMEN1NPSR1 | |
| SCHEMBL14939226 | 0.82 | CXCR3 (0.61) | SIGMAR1LMNANPSR1DRD2 | |
| SCHEMBL14939146 | 0.81 | NR1H4 (0.53) | TSHRNR1H4ALDH1A1ALDH3A1LMNA | |
| SCHEMBL14939801 | 0.81 | NR1H4 (0.53) | TSHRNR1H4ALDH1A1ALDH3A1LMNA | |
| SCHEMBL14939474 | 0.81 | NR1H4 (0.53) | TSHRNR1H4ALDH1A1ALDH3A1LMNA |
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 |