Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 4/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.30 |
| ▸ | GABRP | O00591 | 2/20 | 0.30 |
| ▸ | GABRD | O14764 | 2/20 | 0.30 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.30 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.30 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.30 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.30 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.30 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.30 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.30 |
| ▸ | GABRB2 | P47870 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL110158 | 0.82 | CA1 (0.52) | ALDH1A1TDP1CYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL16791086 | 0.79 | CA1 (0.44) | ALDH1A1TDP1CYP1A2CYP2C19CA2 | |
| SCHEMBL9316340 | 0.78 | — | — | |
| SCHEMBL11604570 | 0.78 | CES2 (0.39) | ALDH1A1TDP1CYP1A2CYP2C19CA1 | |
| SCHEMBL18161881 | 0.78 | CA1 (0.48) | ALDH1A1TDP1CYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL15345276 | 0.78 | ALDH1A1 (0.46) | ALDH1A1TDP1CYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL13817695 | 0.76 | ALDH1A1 (0.40) | ALDH1A1TDP1CYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL19359824 | 0.75 | CYP2C19 (0.46) | ALDH1A1TDP1CYP2C19SMN1; SMN2CA2 | |
| SCHEMBL3407325 | 0.74 | CA2 (0.39) | ALDH1A1TDP1CYP2C19SMN1; SMN2CA2 | |
| SCHEMBL13879345 | 0.74 | ALDH1A1 (0.48) | ALDH1A1TDP1CYP2C19SMN1; SMN2CA2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4016663-B1 | ELECTRODE MATERIAL FOR THE PRINTING OF POLYMER BATTERIES | INNOVATIONLAB GMBH (DE) | 2023-10-11 | — | — | EP | disclosed |