Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MPI | P34949 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | ATG4B | Q9Y4P1 | 5/20 | 0.37 |
| ▸ | MEN1 | O00255 | 4/20 | 0.36 |
| ▸ | NPC1 | O15118 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | GSK3A | P49840 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5916758 | 0.86 | MPI (0.58) | MPISMN1; SMN2CYP1A2CYP3A4TSHR | |
| SCHEMBL10501392 | 0.77 | METAP2 (0.34) | MPICYP3A4HSD17B10ALDH1A1HPGD | |
| SCHEMBL10502231 | 0.77 | METAP2 (0.37) | MPICYP3A4HSD17B10ALDH1A1HPGD | |
| SCHEMBL10747422 | 0.76 | MEN1 (0.41) | MPISMN1; SMN2CYP3A4TSHRHSD17B10 | |
| SCHEMBL10501715 | 0.74 | MEN1 (0.46) | CYP1A2ALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL10502218 | 0.74 | CYP1A2 (0.47) | SMN1; SMN2CYP1A2ALDH1A1NPC1RAB9A | |
| SCHEMBL10501763 | 0.74 | ALDH1A1 (0.44) | MPICYP1A2CYP3A4TSHRHSD17B10 | |
| SCHEMBL10748117 | 0.72 | PIN1 (0.45) | — | |
| SCHEMBL10503512 | 0.71 | ALDH1A1 (0.44) | MPICYP3A4HSD17B10ALDH1A1HPGD | |
| SCHEMBL10745614 | 0.70 | METAP2 (0.35) | MPICYP3A4HSD17B10ALDH1A1HPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0154851-B1 | BENZISOSELENAZOLETHIONES,PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL PRODUCTS CONTAINING THESE COMPOUNDS | A. Nattermann & Cie. GmbH (DE) | 1989-08-02 | — | — | EP | disclosed |
| US-4711961-A | Benzisoselenazolethiones and process for the treatment of various diseases in humans | A. NATTERMANN & CIE GMBH (DE) | 1987-12-08 | — | — | US | disclosed |
| EP-0154851-A1 | Benzisoselenazolethiones,process for their preparation and pharmaceutical products containing these compounds | A. Nattermann & Cie. GmbH (DE) | 1985-09-18 | — | — | EP | disclosed |