Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.42 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.42 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.42 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.42 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.42 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.42 |
| ▸ | TPH1 | P17752 | 1/20 | 0.41 |
| ▸ | TPH2 | Q8IWU9 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.39 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9904089 | 0.75 | ADORA2B (0.55) | PSEN1PSEN2KCNH2APH1BNCSTN | |
| SCHEMBL9904085 | 0.75 | MAOB (0.59) | TP53SMN1; SMN2PSEN1PSEN2KCNH2 | |
| SCHEMBL21153831 | 0.69 | ADORA2B (0.48) | ADORA3ADORA2AADORA2BADORA1 | |
| SCHEMBL18833765 | 0.69 | ALDH1A1 (0.48) | HPGDALDH1A1SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL16029308 | 0.69 | TRPC1 (0.45) | HPGDTP53ALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL16363925 | 0.68 | MAPK1 (0.46) | HPGDTP53ALDH1A1SMN1; SMN2TPH1 | |
| SCHEMBL21153830 | 0.67 | ADORA2B (0.51) | ADORA3ADORA2AADORA2BADORA1 | |
| SCHEMBL9903991 | 0.67 | ADORA2A (0.72) | GPR55ADORA3ADORA2AADORA2BADORA1 | |
| SCHEMBL23067580 | 0.67 | ADORA2B (0.49) | ADORA3ADORA2AADORA2BADORA1 | |
| SCHEMBL638535 | 0.66 | MAPT (0.59) | HPGDALDH1A1SMN1; SMN2KMT2AMEN1 |
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-2465859-A1 | 8-Triazolylxanthine derivatives, processes for their production and their use as adenosine receptor antagonists | Life & Brain GmbH (DE) | 2012-06-20 | — | — | EP | disclosed |
| WO-2012076974-A1 | 8-TRIAZOLYLXANTHINE DERIVATIVES, PROCESSES FOR THEIR PRODUCTION AND THEIR USE AS ADENOSINE RECEPTOR ANTAGONISTS | LIFE & BRAIN GMBH (DE) | 2012-06-14 | — | — | WO | disclosed |