Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 2/20 | 0.44 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.44 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.44 |
| ▸ | IKBKB | O14920 | 1/20 | 0.39 |
| ▸ | CHUK | O15111 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 2/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 3/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.36 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.35 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.35 |
| ▸ | GBA1 | P04062 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | CDC7 | O00311 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28778955 | 0.76 | PLA2G2A (0.47) | PLA2G10PLA2G2ACDC7 | |
| SCHEMBL20400462 | 0.73 | PARP1 (0.44) | IKBKBCHUKPARP1HTR1ASLC6A2 | |
| SCHEMBL28325510 | 0.73 | PARP1 (0.57) | IKBKBCHUKPARP1CDC7 | |
| SCHEMBL15533083 | 0.72 | PARP1 (0.44) | IKBKBCHUKPARP1HTR1ASLC6A2 | |
| SCHEMBL12467974 | 0.72 | GABRA1 (0.43) | GABRA1GABRG2GABRB3PARP1GABRB2 | |
| SCHEMBL28482230 | 0.72 | PARP1 (0.48) | IKBKBCHUKPARP1 | |
| SCHEMBL23111536 | 0.71 | GABRA1 (0.49) | GABRA1GABRG2GABRB3GABRB2HRH1 | |
| SCHEMBL21616607 | 0.71 | PLA2G2A (0.40) | PLA2G10PLA2G2ACDC7 | |
| SCHEMBL12467968 | 0.71 | GABRA1 (0.44) | GABRA1GABRG2GABRB3IKBKBCHUK | |
| SCHEMBL30732577 | 0.70 | PLA2G2A (0.47) | PARP1PLA2G10PLA2G2ACDC7 |
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-0821594-A1 | COMPOUNDS FOR CANCER IMAGING AND THERAPY | JOHN, Christy S. (US) | 1998-02-04 | — | — | EP | disclosed |
| WO-1996032968-A1 | COMPOUNDS FOR CANCER IMAGING AND THERAPY | JOHN CHRISTY S (US) | 1996-10-24 | — | — | WO | disclosed |