Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 5/20 | 0.39 |
| ▸ | HRH2 | P25021 | 4/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | HRH1 | P35367 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9866479 | 0.96 | RAB9A (0.42) | RAB9ASMN1; SMN2NPC1NFKB1NFKB2 | |
| SCHEMBL9866473 | 0.94 | RAB9A (0.42) | RAB9ASMN1; SMN2NPC1NFKB1NFKB2 | |
| SCHEMBL9865750 | 0.93 | RAB9A (0.43) | RAB9ASMN1; SMN2NPC1NFKB1NFKB2 | |
| SCHEMBL9866766 | 0.90 | HRH2 (0.49) | RAB9ASMN1; SMN2NPC1NFKB1NFKB2 | |
| SCHEMBL9866425 | 0.88 | RAB9A (0.42) | RAB9ASMN1; SMN2NPC1HPGDLMNA | |
| SCHEMBL9865732 | 0.86 | HPGD (0.52) | RAB9ASMN1; SMN2NPC1HPGDALDH1A1 | |
| SCHEMBL9865202 | 0.86 | HRH4 (0.43) | RAB9ASMN1; SMN2NPC1NFKB1NFKB2 | |
| SCHEMBL9866047 | 0.86 | HRH4 (0.43) | RAB9ASMN1; SMN2NPC1NFKB1NFKB2 | |
| SCHEMBL11080978 | 0.86 | HRH2 (0.47) | RAB9ANPC1HRH4HRH2 | |
| SCHEMBL9867694 | 0.85 | HRH2 (0.44) | RAB9ASMN1; SMN2NPC1ALDH1A1KMT2A |
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 |