Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.49 |
| ▸ | CPB1 | P15086 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | MGLL | Q99685 | 2/20 | 0.47 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | SLC18A3 | Q16572 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL13176096 | 1.00 | ACHE (0.53) | ACHEKCNH2HTR2ACPB1KMT2A | |
| SCHEMBL18428493 | 0.89 | HTR2A (0.56) | KCNH2HTR2ACPB1KMT2AMEN1 | |
| SCHEMBL324342 | 0.89 | HTR2A (0.56) | KCNH2HTR2ACPB1KMT2AMEN1 | |
| SCHEMBL12050567 | 0.89 | ACHE (0.46) | ACHEKCNH2HTR2ACPB1KMT2A | |
| Acetic Acid SCHEMBL2762930 | 0.88 | HTR2A (0.51) | KCNH2HTR2ACPB1KMT2AMEN1 | |
| Bicarbonate SCHEMBL11468689 | 0.87 | HTR2A (0.54) | KCNH2HTR2ACPB1KMT2AMEN1 | |
| SCHEMBL3515355 | 0.83 | NPC1 (0.52) | KCNH2HTR2ACPB1KMT2AMEN1 | |
| SCHEMBL439217 | 0.83 | NPC1 (0.52) | KCNH2HTR2ACPB1KMT2AMEN1 | |
| SCHEMBL407216 | 0.83 | NPC1 (0.52) | KCNH2HTR2ACPB1KMT2AMEN1 | |
| SCHEMBL14596908 | 0.82 | KMT2A (0.64) | KCNH2KMT2AMEN1MGLLHSD11B1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9739742-B2 | Carbon nanotube sensor | HACH COMPANY | 2017-08-22 | — | — | US | disclosed |
| US-7557113-B2 | Substituted pyrrolo[3,2-d]pyrimidine derivatives | TEIJIN PHARMA LIMITED (JP) | 2009-07-07 | — | — | US | disclosed |
| US-7557113-B2 | Substituted pyrrolo[3,2-d]pyrimidine derivatives | TEIJIN PHARMA LIMITED (JP) | 2009-07-07 | — | — | US | disclosed |
| WO-2006097293-A2 | COMBINATION OF A STEROID SULFATASE INHIBITOR AND AN ASCOMYCIN | NOVARTIS AG (CH) | 2006-09-21 | — | — | WO | disclosed |