Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGBL2 | Q5U5Z8 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | RXRA | P19793 | 2/20 | 0.33 |
| ▸ | RXRB | P28702 | 2/20 | 0.33 |
| ▸ | RXRG | P48443 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.30 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.30 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.30 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.30 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.30 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17839864 | 0.78 | SMN1; SMN2 (0.41) | ALDH1A1KDM4ESMN1; SMN2MAPT | |
| SCHEMBL23859064 | 0.77 | CYP1A2 (0.30) | — | |
| SCHEMBL25371860 | 0.73 | — | — | |
| SCHEMBL6712056 | 0.72 | GABRR1 (0.47) | AGBL2MEN1ALDH1A1GAAKMT2A | |
| SCHEMBL17859552 | 0.72 | ADORA2A (0.36) | ALDH1A1NOTUMKDM4ESMN1; SMN2MAPT | |
| SCHEMBL11130030 | 0.67 | THRB (0.39) | AGBL2MEN1ALDH1A1GAAKMT2A | |
| SCHEMBL17859504 | 0.67 | FBP1 (0.44) | AGBL2ALDH1A1GABRR1NOTUMKDM4E | |
| Bromide SCHEMBL25373420 | 0.66 | SNCA (0.34) | — | |
| SCHEMBL20031269 | 0.65 | GAA (0.41) | AGBL2GAAGABRR1NOTUMKDM4E | |
| SCHEMBL19309585 | 0.63 | GSK3B (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021156439-A1 | TRIAZOLE COMPOUNDS AS ADENOSINE RECEPTOR ANTAGONISTS | ASTRAZENECA AB (SE) | 2021-08-12 | — | — | WO | disclosed |
| WO-2021156439-A1 | TRIAZOLE COMPOUNDS AS ADENOSINE RECEPTOR ANTAGONISTS | ASTRAZENECA AB (SE) | 2021-08-12 | — | — | WO | disclosed |