Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENTPD5 | O75356 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 5/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.45 |
| ▸ | EPAS1 | Q99814 | 2/20 | 0.45 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.41 |
| ▸ | CTSB | P07858 | 1/20 | 0.38 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.37 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 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 | |
|---|---|---|---|---|
| SCHEMBL6786875 | 1.00 | ENTPD5 (0.61) | ENTPD5ALDH1A1CYP3A4CYP2C9TSHR | |
| SCHEMBL31536062 | 0.80 | ENTPD5 (0.74) | ENTPD5ALDH1A1CYP3A4CYP2C9TSHR | |
| SCHEMBL1230920 | 0.77 | ENTPD5 (0.54) | ENTPD5ALDH1A1CYP3A4CYP2C9TSHR | |
| SCHEMBL30628881 | 0.76 | ENTPD5 (1.00) | ENTPD5ALDH1A1CYP3A4CYP2C9TSHR | |
| SCHEMBL31536076 | 0.76 | ENTPD5 (1.00) | ENTPD5ALDH1A1CYP3A4CYP2C9TSHR | |
| SCHEMBL6784834 | 0.75 | ENTPD5 (0.50) | ENTPD5ALDH1A1CYP3A4CYP2C9TSHR | |
| SCHEMBL6785458 | 0.75 | ENTPD5 (0.50) | ENTPD5ALDH1A1CYP3A4CYP2C9TSHR | |
| SCHEMBL25060244 | 0.69 | ALDH1A1 (0.68) | ENTPD5ALDH1A1CYP3A4CYP2C9TSHR | |
| SCHEMBL9572259 | 0.69 | ALDH1A1 (1.00) | ENTPD5ALDH1A1CYP3A4CYP2C9TSHR | |
| SCHEMBL3322341 | 0.69 | ALDH1A1 (1.00) | ENTPD5ALDH1A1CYP3A4CYP2C9TSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6727277-B1 | BENZO(A)XANTHENE DERIVATIVES; LYMPHATIC ABSORPTION INTENSIFIERS 3-HYDROXY-3-METHYLGLUTARYL COENZYME A REDUCTASE INHIBITORS | KANSAS STATE UNIVERSITY RESEARCH FOUNDATION | 2004-04-27 | — | — | US | disclosed |