Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 1/20 | 0.61 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.58 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.58 |
| ▸ | GRIA1 | P42261 | 6/20 | 0.56 |
| ▸ | CACNG8 | Q8WXS5 | 2/20 | 0.56 |
| ▸ | PGR | P06401 | 3/20 | 0.54 |
| ▸ | AHR | P35869 | 2/20 | 0.49 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.49 |
| ▸ | PDE4A | P27815 | 1/20 | 0.47 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.47 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.47 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.47 |
| ▸ | MET | P08581 | 2/20 | 0.46 |
| ▸ | CDC7 | O00311 | 1/20 | 0.46 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.46 |
| ▸ | CDK2 | P24941 | 1/20 | 0.46 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.46 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL29899623 | 0.88 | KDM1A (0.55) | PDE3BPDE3ACYP1A2CYP11B1CYP11B2 | |
| SCHEMBL6744849 | 0.88 | KDM1A (0.55) | PDE3BPDE3ACYP1A2CYP11B1CYP11B2 | |
| SCHEMBL16090416 | 0.85 | ALDH1A1 (0.55) | PDE3BPDE3ACYP1A2CYP11B1CYP11B2 | |
| SCHEMBL1459845 | 0.82 | PDE3B (0.48) | PDE3BPDE3ACYP1A2CYP11B1CYP11B2 | |
| SCHEMBL27481594 | 0.81 | CYP1A2 (0.64) | PDE3BPDE3ACYP1A2CYP11B1CYP11B2 | |
| SCHEMBL1459822 | 0.80 | GRIA1 (0.48) | PDE3BPDE3ACYP1A2CYP11B1CYP11B2 | |
| SCHEMBL15344913 | 0.80 | PDE3B (0.58) | PDE3BPDE3ACYP1A2CYP11B1CYP11B2 | |
| SCHEMBL3132725 | 0.79 | PGR (0.73) | PDE3BPDE3ACYP1A2CYP11B1CYP11B2 | |
| SCHEMBL13680572 | 0.77 | GRIA1 (0.62) | PDE3BPDE3ACYP1A2CYP11B1CYP11B2 | |
| SCHEMBL15341786 | 0.77 | PDE3B (0.55) | PDE3BPDE3ACYP1A2CYP11B1CYP11B2 |
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-1663202-A1 | SUBSTITUTED INDOLES AS INHIBITORS OF POLY (ADP-RIBOSE) POLYMERASE (PARP) | Aventis Pharmaceuticals, Inc. (US) | 2006-06-07 | — | — | EP | disclosed |
| WO-2005023246-A1 | SUBSTITUTED INDOLES AS INHIBITORS OF POLY (ADP-RIBOSE) POLYMERASE (PARP) | AVENTIS PHARMACEUTICALS INC. (US) | 2005-03-17 | — | — | WO | disclosed |