Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR1 | P30556 | 1/20 | 0.49 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.40 |
| ▸ | CXCR5 | P32302 | 2/20 | 0.40 |
| ▸ | APLNR | P35414 | 2/20 | 0.40 |
| ▸ | CCR6 | P51684 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.39 |
| ▸ | HTR6 | P50406 | 1/20 | 0.38 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4150360 | 0.79 | HTR6 (0.54) | ALDH1A1HTTPKMPOLBMAPT | |
| SCHEMBL7370965 | 0.76 | AKR1B1 (0.40) | AGTR1ALDH1A1HTTKDM4ELMNA | |
| SCHEMBL6852624 | 0.75 | CA1 (0.40) | CYP11B1CYP11B2HSD11B1 | |
| SCHEMBL7952665 | 0.74 | CA1 (0.39) | ALDH1A1LMNAMAPTRAB9AHSD11B1 | |
| SCHEMBL10834173 | 0.73 | AGTR1 (0.65) | AGTR1CYP11B1CYP11B2HSP90AA1CXCR5 | |
| SCHEMBL1473557 | 0.73 | PTPRZ1 (0.38) | ALDH1A1HTTLMNAABCC9ABCC8 | |
| SCHEMBL822779 | 0.73 | PKM (0.50) | ALDH1A1HTTPKMPOLBMAPT | |
| SCHEMBL752015 | 0.72 | CXCR2 (0.39) | MAPTKMT2AHSD11B1 | |
| SCHEMBL6943431 | 0.70 | CYP11B1 (0.57) | AGTR1CYP11B1CYP11B2HSP90AA1CXCR5 | |
| SCHEMBL4653156 | 0.70 | AGTR1 (0.57) | AGTR1CYP11B1CYP11B2HSP90AA1CXCR5 |
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-1244669-A1 | PYRAZOLOPYRAZINES AND THEIR USE AS ADENOSINE ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2002-10-02 | — | — | EP | disclosed |
| WO-2001040230-A1 | PYRAZOLOPYRAZINES AND THEIR USE AS ADENOSINE ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2001-06-07 | — | — | WO | disclosed |