Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 2/20 | 0.52 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.52 |
| ▸ | PDK3 | Q15120 | 2/20 | 0.52 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.52 |
| ▸ | CA1 | P00915 | 4/20 | 0.47 |
| ▸ | CA2 | P00918 | 4/20 | 0.47 |
| ▸ | MME | P08473 | 2/20 | 0.47 |
| ▸ | ACE | P12821 | 1/20 | 0.47 |
| ▸ | CPA1 | P15085 | 1/20 | 0.47 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.47 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.45 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.45 |
| ▸ | LNPEP | Q9UIQ6 | 1/20 | 0.45 |
| ▸ | GPR132 | Q9UNW8 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | CTSL | P07711 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3199823 | 0.89 | PDK1 (0.53) | PDK1PDK2PDK3PDK4CA1 | |
| SCHEMBL3222613 | 0.88 | GRN (0.51) | PDK1PDK2PDK3PDK4MME | |
| SCHEMBL3213081 | 0.88 | GPR132 (0.50) | PDK1PDK2PDK3PDK4CA1 | |
| SCHEMBL3218617 | 0.86 | PDK1 (0.42) | PDK1PDK2PDK3PDK4CA1 | |
| SCHEMBL3222001 | 0.86 | GPR132 (0.55) | PDK1PDK2PDK3PDK4GPR132 | |
| SCHEMBL775117 | 0.81 | CA2 (0.64) | CA1CA2MEN1KMT2ACYP1A2 | |
| SCHEMBL18653875 | 0.77 | LNPEP (0.52) | PDK1PDK2PDK3PDK4ERAP2 | |
| SCHEMBL15989069 | 0.77 | LNPEP (0.52) | PDK1PDK2PDK3PDK4ERAP2 | |
| SCHEMBL775213 | 0.77 | GRN (0.59) | PDK1PDK2PDK3PDK4CA1 | |
| SCHEMBL3215269 | 0.75 | PDK1 (0.52) | PDK1PDK2PDK3PDK4CA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7683097-B2 | Topoisomerase inhibitors | Propharmacon Inc. (US) | 2010-03-23 | — | — | US | claimed |