Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALB | P02768 | 2/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5774563 | 0.83 | ALB (0.69) | ALBSMN1; SMN2MAPTKDM4EALDH1A1 | |
| SCHEMBL5776249 | 0.78 | HTT (0.58) | ALBSMN1; SMN2MAPTKDM4EALDH1A1 | |
| SCHEMBL5775071 | 0.78 | ALB (0.60) | ALBSMN1; SMN2MAPTKDM4EALDH1A1 | |
| SCHEMBL5778735 | 0.77 | ALB (0.57) | ALBSMN1; SMN2MAPTKDM4EALDH1A1 | |
| SCHEMBL9094397 | 0.76 | KDM4E (0.70) | ALBSMN1; SMN2MAPTKDM4EALDH1A1 | |
| SCHEMBL9094380 | 0.76 | KDM4E (0.70) | ALBSMN1; SMN2MAPTKDM4EALDH1A1 | |
| Acetic Acid SCHEMBL9263859 | 0.76 | ALB (0.75) | ALBSMN1; SMN2MAPTKDM4EALDH1A1 | |
| Acetic Acid SCHEMBL9263847 | 0.76 | ALB (0.75) | ALBSMN1; SMN2MAPTKDM4EALDH1A1 | |
| SCHEMBL5778584 | 0.76 | ALB (0.60) | ALBSMN1; SMN2MAPTKDM4EALDH1A1 | |
| SCHEMBL9264563 | 0.75 | ALB (0.71) | ALBSMN1; SMN2MAPTKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1652839-A2 | Drug efflux pump inhibitor | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 2006-05-03 | — | — | EP | disclosed |
| EP-1227084-B1 | DRUG DISCHARGE PUMP INHIBITORS | TRINE PHARMACEUTICALS INC (US) | 2005-12-14 | — | — | EP | disclosed |
| EP-1227084-A1 | DRUG DISCHARGE PUMP INHIBITORS | Microcide Pharmaceuticals, Inc. (US) | 2002-07-31 | — | — | EP | disclosed |