Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 2/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | PRKACA | P17612 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 5/20 | 0.39 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.38 |
| ▸ | FEN1 | P39748 | 1/20 | 0.38 |
| ▸ | BCL6 | P41182 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 2/20 | 0.36 |
| ▸ | GABRP | O00591 | 1/20 | 0.36 |
| ▸ | GABRD | O14764 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.36 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 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 | |
|---|---|---|---|---|
| SCHEMBL1505810 | 0.80 | LMNA (0.37) | HSP90AA1GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL27638894 | 0.79 | NUDT1 (0.50) | NUDT1ROCK1HRH4CDC7 | |
| SCHEMBL686891 | 0.78 | MAPT (0.33) | HSP90AA1HDAC6POLB | |
| SCHEMBL9565270 | 0.78 | PLAAT3 (0.37) | HDAC6POLB | |
| Bromide SCHEMBL5348109 | 0.78 | NUDT1 (0.49) | NUDT1HSP90AA1AURKAPRKACAADORA2A | |
| SCHEMBL8393570 | 0.77 | SORT1 (0.37) | GRM4HDAC6 | |
| SCHEMBL11212136 | 0.74 | NUDT1 (0.57) | NUDT1HSP90AA1AURKAPRKACAADORA2A | |
| SCHEMBL1885320 | 0.74 | NUDT1 (0.46) | NUDT1HSP90AA1AURKAPRKACAADORA2A | |
| SCHEMBL11303883 | 0.73 | — | — | |
| SCHEMBL686300 | 0.73 | KMT2A (0.32) | — |
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-1888579-B1 | NOVEL FLUORENE DERIVATIVES, COMPOSITION CONTAINING SAID DERIVATIVES AND THE USE THEREOF | AVENTIS PHARMA SA (FR) | 2011-08-03 | — | — | EP | claimed |
| EP-3083586-B1 | NOVEL CARBOXAMIDES, METHOD FOR THE PRODUCTION THEREOF, PHARMACEUTICAL PREPARATIONS COMPRISING THEM, AND USE THEREOF FOR PRODUCING MEDICAMENTS | Bayer Pharma AG (DE) | 2018-04-18 | — | — | EP | disclosed |
| EP-0511072-A1 | 2-Aminopyrimidin-4-carboxamid derivatives, their preparation and their therapeutical use | SYNTHELABO (FR) | 1992-10-28 | — | — | EP | disclosed |