Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | PTPRZ1 | P23471 | 3/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 2/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.33 |
| ▸ | FLT3 | P36888 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL901110 | 0.83 | SMN1; SMN2 (0.49) | SMN1; SMN2KDM4EALDH1A1TDP1PTPRZ1 | |
| SCHEMBL12828098 | 0.83 | SMN1; SMN2 (0.51) | SMN1; SMN2KDM4EALDH1A1TDP1PTPRZ1 | |
| SCHEMBL16707555 | 0.79 | SMN1; SMN2 (0.49) | SMN1; SMN2KDM4EALDH1A1TDP1PTPRZ1 | |
| SCHEMBL1128300 | 0.78 | SMN1; SMN2 (0.47) | SMN1; SMN2KDM4EALDH1A1TDP1PTPRZ1 | |
| SCHEMBL21225496 | 0.78 | SMN1; SMN2 (0.47) | SMN1; SMN2KDM4EALDH1A1TDP1PTPRZ1 | |
| SCHEMBL4157946 | 0.78 | ALDH1A1 (0.52) | SMN1; SMN2KDM4EALDH1A1TDP1PTPRZ1 | |
| SCHEMBL29528601 | 0.78 | SMN1; SMN2 (0.47) | SMN1; SMN2KDM4EALDH1A1TDP1PTPRZ1 | |
| SCHEMBL28304139 | 0.78 | SMN1; SMN2 (0.47) | SMN1; SMN2KDM4EALDH1A1TDP1PTPRZ1 | |
| SCHEMBL8772911 | 0.76 | MAPT (0.40) | KDM4EALDH1A1MAPTTSHRTP53 | |
| SCHEMBL900727 | 0.75 | ALDH1A1 (0.43) | SMN1; SMN2KDM4EALDH1A1TDP1PTPRZ1 |
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-2621922-A1 | A PROCESS FOR THE SYNTHESIS OF THIO-TRIAZOLO-GROUP CONTAINING COMPOUNDS | BASF SE (DE) | 2013-08-07 | — | — | EP | disclosed |
| WO-2012041858-A1 | A PROCESS FOR THE SYNTHESIS OF THIO-TRIAZOLO-GROUP CONTAINING COMPOUNDS | BASF SE (DE) | 2012-04-05 | — | — | WO | disclosed |