Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 4/20 | 0.40 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.40 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.36 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.36 |
| ▸ | GABRP | O00591 | 1/20 | 0.35 |
| ▸ | GABRD | O14764 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 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 | |
|---|---|---|---|---|
| SCHEMBL2959480 | 0.87 | TSHR (0.58) | TSHRHSD17B10CYP11B1CYP11B2KCNJ1 | |
| SCHEMBL7396265 | 0.85 | TSHR (0.61) | TSHRHSD17B10CYP11B1CYP11B2KCNJ1 | |
| SCHEMBL4060135 | 0.85 | TSHR (0.61) | TSHRHSD17B10CYP11B1CYP11B2KCNJ1 | |
| SCHEMBL5631364 | 0.85 | CA2 (0.44) | TSHRCA2HRH3LOXL2CYP2A6 | |
| SCHEMBL21623419 | 0.83 | TSHR (0.56) | TSHRHSD17B10FFAR1FFAR4KCNJ1 | |
| SCHEMBL21623468 | 0.83 | TSHR (0.50) | TSHRHSD17B10FFAR1FFAR4KCNJ1 | |
| SCHEMBL7395296 | 0.81 | GABRP (0.47) | CYP11B1CYP11B2FFAR1FFAR4CA2 | |
| SCHEMBL81846 | 0.81 | TSHR (0.55) | TSHRHSD17B10CYP11B1CYP11B2KCNJ1 | |
| SCHEMBL10569888 | 0.77 | TSHR (0.68) | TSHRHSD17B10KCNJ1KCNH2CA2 | |
| SCHEMBL10773059 | 0.76 | TSHR (0.64) | TSHRHSD17B10CYP11B1CYP11B2KCNJ1 |
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-1389211-A1 | 3,7-DIAZYBICYCLO 3.3.1] FORMULATIONS AS ANTIARRHYTMIC COMPOUNDS | AstraZeneca AB (SE) | 2004-02-18 | — | — | EP | disclosed |
| WO-2002083687-A1 | 3,7-DIAZYBICYCLO [3.3.1] FORMULATIONS AS ANTIARRHYTMIC COMPOUNDS | ASTRAZENECA AB (SE) | 2002-10-24 | — | — | WO | disclosed |