Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.34 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | HRH2 | P25021 | 2/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
| ▸ | NQO2 | P16083 | 1/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10368541 | 1.00 | CYP1A2 (0.36) | CYP1A2ALDH1A1HPGDHTR1ADRD2 | |
| SCHEMBL9865848 | 0.94 | ALDH1A1 (0.39) | CYP1A2ALDH1A1HPGDSCN5ASCN2A | |
| SCHEMBL9867644 | 0.87 | SCN5A (0.45) | ALDH1A1HPGDSCN5ASCN2ASMN1; SMN2 | |
| SCHEMBL9867640 | 0.87 | SCN5A (0.45) | ALDH1A1HPGDSCN5ASCN2ASMN1; SMN2 | |
| SCHEMBL9866419 | 0.87 | RAB9A (0.42) | CYP1A2ALDH1A1SCN5ASCN2ACYP2C19 | |
| SCHEMBL9866134 | 0.85 | SCN5A (0.37) | SCN5ASCN2ASMN1; SMN2HRH2MTNR1B | |
| SCHEMBL9866505 | 0.85 | PSMB5 (0.44) | HTR1ADRD2HTR2AHTR2CDRD3 | |
| SCHEMBL9866141 | 0.85 | SCN5A (0.37) | SCN5ASCN2ASMN1; SMN2HRH2MTNR1B | |
| SCHEMBL9867007 | 0.84 | SCN5A (0.40) | CYP1A2ALDH1A1SCN5ASCN2ACYP2C9 | |
| SCHEMBL9865157 | 0.84 | ALDH1A1 (0.44) | ALDH1A1HPGDSCN5ASCN2ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5021431-A | H-1 antagonist, h-2 agonist for treating hypertension, cardiac disease or arterial occlusion | HEUMANN PHARMA GMBH & CO. (DE) | 1991-06-04 | — | — | US | disclosed |
| EP-0199845-B1 | IMIDAZOLYLALKYLGUANIDIN DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | HEUMANN PHARMA GMBH & CO (DE) | 1990-08-01 | — | — | EP | disclosed |
| EP-0199845-A1 | Imidazolylalkylguanidin derivatives, process for their preparation and pharmaceutical compositions containing them | HEUMANN PHARMA GMBH & CO (DE) | 1986-11-05 | — | — | EP | disclosed |