Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.51 |
| ▸ | ACHE | P22303 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.48 |
| ▸ | PPARG | P37231 | 1/20 | 0.47 |
| ▸ | PPARD | Q03181 | 1/20 | 0.47 |
| ▸ | PPARA | Q07869 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1023514 | 1.00 | CA2 (0.51) | CA2CA1ACHEALDH1A1LMNA | |
| SCHEMBL1023517 | 1.00 | CA2 (0.51) | CA2CA1ACHEALDH1A1LMNA | |
| Hydrochloric Acid SCHEMBL9829432 | 0.98 | CA2 (0.50) | CA2CA1ACHEALDH1A1LMNA | |
| SCHEMBL5955077 | 0.84 | ACHE (0.50) | CA2CA1ACHEALDH1A1LMNA | |
| SCHEMBL12294903 | 0.81 | ALDH1A1 (0.47) | ALDH1A1TAAR1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8298141 | 0.81 | ALDH1A1 (0.60) | CA2CA1ACHEALDH1A1LMNA | |
| SCHEMBL20630776 | 0.81 | PPARG (0.46) | CA2CA1ACHEALDH1A1LMNA | |
| SCHEMBL19546085 | 0.81 | PPARG (0.46) | CA2CA1ACHEALDH1A1LMNA | |
| SCHEMBL29511863 | 0.81 | HIF1A (0.58) | ALDH1A1LMNAMAPTALOX12PPARG | |
| SCHEMBL3652526 | 0.81 | HIF1A (0.58) | ALDH1A1LMNAMAPTALOX12PPARG |
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-2011000915-A1 | ISOFORM-SELECTIVE HCN BLOCKERS | UNIVERSITA' DEGLI STUDI DI FIRENZE (IT) | 2011-01-06 | — | — | WO | disclosed |