Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCF1 | P14598 | 3/20 | 0.66 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.41 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | GAK | O14976 | 1/20 | 0.39 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.39 |
| ▸ | COQ8A | Q8NI60 | 1/20 | 0.39 |
| ▸ | NLK | Q9UBE8 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6225664 | 0.81 | NCF1 (0.64) | NCF1SLC22A12GAAMEN1KMT2A | |
| SCHEMBL6636311 | 0.80 | NCF1 (1.00) | NCF1HTR1AGAACYP1A2CYP3A4 | |
| SCHEMBL6217565 | 0.72 | KDM4E (0.58) | NCF1LMNAKDM4ENPSR1HTR1A | |
| SCHEMBL30337987 | 0.70 | NCF1 (0.65) | NCF1LMNAKDM4ENPSR1MAPK1 | |
| SCHEMBL5133941 | 0.70 | GAA (0.63) | NCF1KDM4EHTR1AADRA1DADRA1A | |
| SCHEMBL28549710 | 0.70 | ADRB1 (0.54) | HTR1AMAPK1ALDH1A1HPGDHSD17B10 | |
| SCHEMBL1041663 | 0.69 | NCF1 (0.81) | NCF1GAAHSD17B10 | |
| SCHEMBL1223373 | 0.69 | NCF1 (0.64) | NCF1LMNAKDM4ENPSR1HTR1A | |
| Hydrochloric Acid SCHEMBL5035840 | 0.69 | GAA (0.62) | NCF1KDM4ENPSR1HTR1AADRA1D | |
| SCHEMBL3073912 | 0.68 | NCF1 (0.56) | NCF1LMNAKDM4ENPSR1HTR1A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1537121-A1 | ANTIDEPRESSANT ARYLPIPERAZINE DERIVATIVES OF HETEROCYCLE-FUSED BENZODIOXANS | Wyeth (US) | 2005-06-08 | — | — | EP | disclosed |
| WO-2004024731-A1 | ANTIDEPRESSANT ARYLPIPERAZINE DERIVATIVES OF HETEROCYCLE-FUSED BENZODIOXANS | WYETH (US) | 2004-03-25 | — | — | WO | disclosed |