Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | AMY1A | P0DUB6 | 6/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | PDE2A | O00408 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.45 |
| ▸ | RELA | Q04206 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL10734755 | 0.89 | PDE2A (0.57) | PDE5AKDM4ESMN1; SMN2HSD17B10HTT | |
| SCHEMBL10740337 | 0.84 | TOP1 (0.41) | PDE5AKDM4ESMN1; SMN2HSD17B10HTT | |
| SCHEMBL7281035 | 0.84 | PDE5A (0.55) | PDE5AKDM4ESMN1; SMN2HSD17B10HTT | |
| SCHEMBL10739533 | 0.83 | MGAM (0.57) | KDM4ESMN1; SMN2HSD17B10AMY1AALDH1A1 | |
| Hydrochloric Acid SCHEMBL10844959 | 0.83 | PDE5A (0.56) | PDE5AKDM4ESMN1; SMN2HSD17B10HTT | |
| Hydrochloric Acid SCHEMBL7272791 | 0.83 | PDE5A (0.56) | PDE5AKDM4ESMN1; SMN2HSD17B10HTT | |
| SCHEMBL10743332 | 0.83 | PDE5A (0.45) | PDE5AKDM4EAMY1AALDH1A1HPGD | |
| SCHEMBL10742077 | 0.82 | AMY1A (0.48) | PDE5AKDM4ESMN1; SMN2HSD17B10HTT | |
| SCHEMBL15643913 | 0.82 | SMN1; SMN2 (0.64) | PDE5AKDM4ESMN1; SMN2HSD17B10HTT | |
| SCHEMBL10734339 | 0.81 | PDE5A (0.70) | PDE5AKDM4ESMN1; SMN2AMY1AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4654344-A | ALSO AFFECT BLOOD PRESSURE AND MYOCARDIAL CONTRACTIONS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1987-03-31 | — | — | US | disclosed |
| EP-0093951-B1 | 2-ARYL-TETRAAZAINDENES | MERCK PATENT GmbH (DE) | 1986-10-29 | — | — | EP | disclosed |
| US-4575505-A | Pharmaceutical compositions containing 2-aryltetraazaindenes for treating ulcers or cardiac insufficiency or blood pressure abnormalities | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1986-03-11 | — | — | US | disclosed |
| US-4477454-A | INDOTROPIC AGENTS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1984-10-16 | — | — | US | disclosed |
| EP-0093951-A2 | 2-Aryl-tetraazaindenes | MERCK PATENT GmbH (DE) | 1983-11-16 | — | — | EP | disclosed |