Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 2/20 | 0.34 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | PDE2A | O00408 | 1/20 | 0.34 |
| ▸ | FFAR4 | Q5NUL3 | 4/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16707483 | 0.81 | TRPA1 (0.43) | SMN1; SMN2LMNAGAAACHEFFAR4 | |
| SCHEMBL476656 | 0.80 | ACHE (0.41) | SMN1; SMN2LMNAGAAACHEFFAR4 | |
| Ammonia Solution, Strong SCHEMBL27817193 | 0.78 | ACHE (0.39) | SMN1; SMN2LMNAGAAACHEFFAR4 | |
| SCHEMBL575672 | 0.78 | ACHE (0.40) | ACHEKIF11TRPA1ATMCYP1A2 | |
| SCHEMBL577144 | 0.78 | ACHE (0.40) | ACHEKIF11TRPA1ATMCYP1A2 | |
| SCHEMBL2783365 | 0.77 | ALDH1A1 (0.33) | PDE2AFFAR4PDK2ALDH1A1PKM | |
| SCHEMBL1145218 | 0.76 | ACHE (0.39) | SMN1; SMN2LMNAACHEKIF11TRPA1 | |
| SCHEMBL10974613 | 0.75 | CYP1A2 (0.32) | LMNAPDE2AFFAR4PDK2CYP1A2 | |
| SCHEMBL900416 | 0.75 | ALDH1A1 (0.32) | PDE2AALDH1A1PKMHPGDHTT | |
| SCHEMBL900553 | 0.75 | ACHE (0.34) | SMN1; SMN2GAAACHEPDE2AFFAR4 |
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 |