Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.61 |
| ▸ | GAA | P10253 | 2/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.61 |
| ▸ | MPO | P05164 | 1/20 | 0.61 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.61 |
| ▸ | HTT | P42858 | 3/20 | 0.57 |
| ▸ | HPGD | P15428 | 3/20 | 0.57 |
| ▸ | NPC1 | O15118 | 3/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | MAPT | P10636 | 3/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.57 |
| ▸ | NAAA | Q02083 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 3/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.55 |
| ▸ | TP53 | P04637 | 2/20 | 0.55 |
| ▸ | CA1 | P00915 | 4/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL31119121 | 0.85 | HTT (0.69) | KDM4EGAASMN1; SMN2MPOHIF1A | |
| SCHEMBL12083361 | 0.85 | KDM4E (0.63) | KDM4EGAASMN1; SMN2MPOHIF1A | |
| SCHEMBL5707054 | 0.85 | HTT (0.69) | KDM4EGAASMN1; SMN2MPOHIF1A | |
| SCHEMBL31119120 | 0.85 | HTT (0.69) | KDM4EGAASMN1; SMN2MPOHIF1A | |
| Salicyluric Acid SCHEMBL29935452 | 0.84 | HPGD (0.58) | KDM4EGAASMN1; SMN2MPOHIF1A | |
| Salicyluric Acid SCHEMBL570541 | 0.84 | HPGD (0.58) | KDM4EGAASMN1; SMN2MPOHIF1A | |
| SCHEMBL1668940 | 0.84 | ALDH1A1 (0.65) | KDM4EGAASMN1; SMN2MPOHIF1A | |
| Hydrochloric Acid SCHEMBL15769882 | 0.83 | HTT (0.67) | KDM4EGAASMN1; SMN2MPOHIF1A | |
| SCHEMBL8346286 | 0.83 | HTT (0.67) | KDM4EGAASMN1; SMN2MPOHIF1A | |
| SCHEMBL12562532 | 0.82 | NAAA (0.57) | KDM4EGAASMN1; SMN2MPOHIF1A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0271059-B1 | 2-Methylthiomethyl-dihydropyridines, a process for their preparation and pharmaceutical compositions containing them | BOEHRINGER MANNHEIM ITALIA (IT) | 1993-10-20 | — | — | EP | disclosed |
| US-4971984-A | Cardiovascular disorders, hypotensive agints | BEEHRINGER BIOCHEMIA ROBIN S.P.A. (IT) | 1990-11-20 | — | — | US | disclosed |
| US-4044153-A | ANTIEDEMIC | MERCK & CO., INC. (US) | 1977-08-23 | — | — | US | disclosed |
| US-4029816-A | ANTIHYPERTENSIVE, DIURETIC, SALURETIC | MERCK & CO., INC. (US) | 1977-06-14 | — | — | US | disclosed |
| US-3979361-A | ANTIEDEMA, ANTIINFLAMMATORY | MERCK & CO., INC. (US) | 1976-09-07 | — | — | US | disclosed |