Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.42 |
| ▸ | RAB9A | P51151 | 6/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.41 |
| ▸ | HRH2 | P25021 | 4/20 | 0.41 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.37 |
| ▸ | RELA | Q04206 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL9866763 | 1.00 | NPC1 (0.42) | NPC1RAB9ASMN1; SMN2RECQLHRH4 | |
| SCHEMBL10369046 | 0.95 | HRH4 (0.42) | NPC1RAB9ASMN1; SMN2RECQLHRH4 | |
| SCHEMBL9866485 | 0.95 | HRH4 (0.42) | NPC1RAB9ASMN1; SMN2RECQLHRH4 | |
| SCHEMBL9865721 | 0.94 | HPGD (0.47) | NPC1RAB9ASMN1; SMN2RECQLHRH4 | |
| SCHEMBL9865207 | 0.94 | NPC1 (0.37) | NPC1RAB9ASMN1; SMN2RECQLHRH4 | |
| SCHEMBL9865726 | 0.94 | HPGD (0.47) | NPC1RAB9ASMN1; SMN2RECQLHRH4 | |
| SCHEMBL9867694 | 0.94 | HRH2 (0.44) | NPC1RAB9ASMN1; SMN2RECQLHRH4 | |
| SCHEMBL9866766 | 0.93 | HRH2 (0.49) | NPC1RAB9ASMN1; SMN2RECQLHRH4 | |
| SCHEMBL9865750 | 0.90 | RAB9A (0.43) | NPC1RAB9ASMN1; SMN2HRH4HRH2 | |
| SCHEMBL9865876 | 0.89 | HPGD (0.46) | NPC1RAB9ASMN1; SMN2RECQLHRH4 |
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 |
|---|---|---|---|---|---|---|---|
| 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-A1 | Imidazolylalkylguanidin derivatives, process for their preparation and pharmaceutical compositions containing them | HEUMANN PHARMA GMBH & CO (DE) | 1986-11-05 | — | — | EP | disclosed |