Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | KCNJ1 | P48048 | 3/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | PNP | P00491 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | PLCG2 | P16885 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4416381 | 0.88 | GAA (0.39) | POLBGAALMNACYP3A4KMT2A | |
| SCHEMBL4416313 | 0.83 | CYP19A1 (0.37) | CYP3A4KCNJ1SIGMAR1KMT2APKM | |
| SCHEMBL5567623 | 0.68 | MEN1 (0.31) | POLBKMT2AUSP2MEN1 | |
| SCHEMBL5040863 | 0.66 | THRB (0.55) | POLBGAALMNAKMT2ATSHR | |
| SCHEMBL1333522 | 0.66 | ADORA2B (0.58) | CYP3A4 | |
| SCHEMBL4412642 | 0.64 | MEN1 (0.41) | POLBGAALMNASIGMAR1KMT2A | |
| SCHEMBL8096572 | 0.60 | POLB (0.61) | POLBKCNJ1SIGMAR1KMT2ATSHR | |
| SCHEMBL11770983 | 0.60 | KCNJ1 (0.48) | POLBGAACYP3A4KCNJ1SIGMAR1 | |
| SCHEMBL18913824 | 0.60 | TSHR (0.69) | POLBKCNJ1SIGMAR1TSHRKCNH2 | |
| SCHEMBL9325748 | 0.59 | KCNH2 (0.49) | POLBLMNAKMT2AMEN1KCNH2 |
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-1601649-A4 | A1 ADENOSINE RECEPTOR ANTAGONISTS | ENDACEA INC (US) | 2009-03-04 | — | — | EP | disclosed |
| EP-1601649-A2 | A1 ADENOSINE RECEPTOR ANTAGONISTS | Endacea Inc. (US) | 2005-12-07 | — | — | EP | disclosed |
| WO-2004074247-A2 | A1 ADENOSINE RECEPTOR ANTAGONISTS | ENDACEA, INC. (US) | 2004-09-02 | — | — | WO | disclosed |