Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 7/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.40 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22609096 | 1.00 | PDK2 (0.44) | PDK2KMT2ACYP1A2CYP2C19AKR1A1 | |
| SCHEMBL20089623 | 0.89 | PDK2 (0.45) | PDK2KMT2ACYP1A2CYP2C19AKR1A1 | |
| SCHEMBL11990868 | 0.85 | PDK2 (0.56) | PDK2KMT2ACYP1A2CYP2C19LMNA | |
| SCHEMBL30322608 | 0.85 | PDK2 (0.56) | PDK2KMT2ACYP1A2CYP2C19LMNA | |
| SCHEMBL19147675 | 0.83 | PDK2 (0.58) | PDK2KMT2AAKR1A1AKR1B1LMNA | |
| SCHEMBL14099222 | 0.82 | PDK2 (0.44) | PDK2KMT2ACYP1A2CYP2C19LMNA | |
| SCHEMBL16547417 | 0.82 | PDK2 (0.44) | PDK2KMT2ACYP1A2CYP2C19LMNA | |
| SCHEMBL17816711 | 0.82 | PDK2 (0.56) | PDK2KMT2AAKR1A1AKR1B1LMNA | |
| SCHEMBL32682807 | 0.80 | PDK2 (0.49) | PDK2KMT2ACYP1A2CYP2C19LMNA | |
| SCHEMBL5344736 | 0.80 | PDK2 (0.49) | PDK2KMT2ACYP1A2CYP2C19LMNA |
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-3962895-A1 | COMPOUNDS COMPRISING A HETERO-FLUORENE GROUP | Novaled GmbH (DE) | 2022-03-09 | — | — | EP | disclosed |