Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 6/20 | 0.40 |
| ▸ | MAPT | P10636 | 5/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.38 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.37 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.37 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.37 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.37 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.37 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.36 |
| ▸ | PTGES | O14684 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL12633458 | 0.90 | PTGDR2 (0.40) | PTGDR2MAPTCA12CYP1A2CYP3A4 | |
| SCHEMBL2033730 | 0.84 | PTGDR2 (0.40) | PTGDR2PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL2041118 | 0.81 | PTGDR2 (0.47) | PTGDR2MAPTCYP1A2CYP3A4PLA2G2A | |
| SCHEMBL2040047 | 0.81 | GLA (0.39) | PTGDR2MAPTAGTR1PSEN1PSEN2 | |
| SCHEMBL13572665 | 0.73 | PTGDR2 (0.38) | PTGDR2MAPTAGTR1PSEN1PSEN2 | |
| SCHEMBL2041243 | 0.73 | PTGDR2 (0.41) | PTGDR2ALDH1A1LMNAHTT | |
| SCHEMBL2035534 | 0.72 | PTGDR2 (0.41) | PTGDR2PLA2G2A | |
| SCHEMBL2038633 | 0.71 | GLA (0.39) | PTGDR2MAPTCYP3A4AGTR1PSEN1 | |
| SCHEMBL1889325 | 0.70 | PTGDR2 (0.47) | PTGDR2MAPTCYP1A2CYP3A4HTT | |
| SCHEMBL2043551 | 0.70 | PTGDR2 (0.47) | PTGDR2MAPTCYP1A2CYP3A4PLA2G2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011073263-A1 | 1, 7 - DIAZACARBAZOLES AND THEIR USE IN THE TREATMENT OF CANCER | F. HOFFMANN-LA ROCHE AG (CH) | 2011-06-23 | — | — | WO | disclosed |