Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | P2RX7 | Q99572 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5029175 | 0.83 | KCNA5 (0.49) | ALDH1A1NPSR1POLBMAPTLMNA | |
| SCHEMBL5027031 | 0.81 | KCNA5 (0.50) | KDM4EALDH1A1POLBMAPTLMNA | |
| SCHEMBL5028997 | 0.80 | SMN1; SMN2 (0.42) | KDM4EALDH1A1NPSR1POLBMAPT | |
| SCHEMBL10839633 | 0.74 | CYP2D6 (0.47) | KDM4EALDH1A1RECQLNPSR1POLB | |
| SCHEMBL5114145 | 0.74 | ALDH1A1 (0.44) | KDM4EALDH1A1RECQLNPSR1POLB | |
| SCHEMBL3114045 | 0.70 | ALDH1A1 (0.67) | KDM4EALDH1A1RECQLPOLBMAPK1 | |
| SCHEMBL7120061 | 0.70 | DPP4 (0.53) | KDM4EALDH1A1RECQLNPSR1POLB | |
| SCHEMBL3467668 | 0.70 | ALDH1A1 (0.55) | KDM4EALDH1A1NPSR1POLBMAPK1 | |
| SCHEMBL21438215 | 0.69 | L3MBTL1 (0.45) | KDM4EALDH1A1NPSR1MAPTL3MBTL1 | |
| SCHEMBL1516145 | 0.66 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1LMNAKCNA5CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2007393-A2 | THIAZOLE AND THIOPHENE ANALOGUES, AND THEIR USE IN TREATING AUTOIMMUNE DISEASES AND CANCERS | Board Of Supervisors Of Louisiana State University And Agricultural And Mechanical College (US) | 2008-12-31 | — | — | EP | disclosed |
| WO-2007118149-A2 | THIAZOLE AND THIOPHENE ANALOGUES, AND THEIR USE IN TREATING AUTOIMMUNE DISEASES AND CANCERS | BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL LOLLEGE (US) | 2007-10-18 | — | — | WO | disclosed |