Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACLY | P53396 | 1/20 | 0.35 |
| ▸ | ACACB | O00763 | 1/20 | 0.34 |
| ▸ | ACACA | Q13085 | 1/20 | 0.34 |
| ▸ | CES2 | O00748 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.31 |
| ▸ | CPT2 | P23786 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.30 |
| ▸ | LTB4R | Q15722 | 2/20 | 0.30 |
| ▸ | EPHX2 | P34913 | 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 | |
|---|---|---|---|---|
| SCHEMBL9056783 | 0.98 | ACLY (0.34) | ACLYACACBACACACES2GAA | |
| SCHEMBL9620660 | 0.86 | ACLY (0.43) | ACLYACACBACACAALDH1A1TP53 | |
| SCHEMBL9620785 | 0.86 | ACLY (0.43) | ACLYACACBACACAALDH1A1TP53 | |
| SCHEMBL9620360 | 0.86 | ACLY (0.43) | ACLYACACBACACAALDH1A1TP53 | |
| SCHEMBL9060464 | 0.86 | ACLY (0.43) | ACLYACACBACACAALDH1A1TP53 | |
| SCHEMBL9620703 | 0.83 | TSHR (0.44) | ACLYACACBACACAALDH1A1TP53 | |
| SCHEMBL7619429 | 0.82 | FAAH (0.48) | FFAR1TDP1MAPTLTB4R | |
| SCHEMBL14269711 | 0.78 | ACLY (0.59) | ACLYACACBACACATSHRTDP1 | |
| SCHEMBL5531453 | 0.78 | ACLY (0.59) | ACLYACACBACACATSHRTDP1 | |
| SCHEMBL5524941 | 0.78 | ACLY (0.59) | ACLYACACBACACATSHRTDP1 |
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-1996011901-A1 | NOVEL α,α,α',α'-TETRACHLOROBICARBOXYLIC ACIDS, PROCESS FOR PRODUCING THEM AND MEDICAMENTS CONTAINING THEM | BOEHRINGER MANNHEIM GMBH (DE) | 1996-04-25 | — | — | WO | disclosed |