Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE1B | Q01064 | 6/20 | 0.42 |
| ▸ | PDE1A | P54750 | 4/20 | 0.42 |
| ▸ | PDE1C | Q14123 | 4/20 | 0.42 |
| ▸ | RAD52 | P43351 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | PDE5A | O76074 | 3/20 | 0.40 |
| ▸ | CCR1 | P32246 | 1/20 | 0.39 |
| ▸ | CCR5 | P51681 | 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 | |
|---|---|---|---|---|
| SCHEMBL10787135 | 0.77 | ALDH1A1 (0.45) | PDE1BPDE1APDE1CRAD52ALDH1A1 | |
| SCHEMBL246387 | 0.76 | MEN1 (0.42) | PDE1BPDE1APDE1CALDH1A1KDM4E | |
| SCHEMBL12844112 | 0.71 | PDE1B (0.55) | PDE1BPDE1APDE1CALDH1A1KDM4E | |
| SCHEMBL30492582 | 0.71 | CCR1 (0.45) | PDE1BPDE1APDE1CALDH1A1KDM4E | |
| SCHEMBL3156666 | 0.71 | CCR1 (0.45) | PDE1BPDE1APDE1CALDH1A1KDM4E | |
| SCHEMBL248603 | 0.68 | PDPK1 (0.53) | PDPK1DAPK3PRKD3FLT1RPS6KA3 | |
| SCHEMBL1556931 | 0.67 | KDM4E (0.45) | PDE1BPDE1APDE1CALDH1A1KDM4E | |
| SCHEMBL28446875 | 0.67 | MEN1 (0.45) | PDE1BPDE1APDE1CALDH1A1KDM4E | |
| SCHEMBL31436390 | 0.67 | KDM4E (0.45) | PDE1BPDE1APDE1CALDH1A1KDM4E | |
| SCHEMBL30605542 | 0.67 | PDE1B (0.54) | PDE1BPDE1APDE1CALDH1A1KDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2588457-B1 | PYRAZOLOQUINOLINE DERIVATIVES AS DNA-PK INHIBITORS | MERCK PATENT GMBH (DE) | 2014-11-05 | — | — | EP | disclosed |
| EP-2588457-A1 | PYRAZOLO-QUINOLINES | Merck Patent GmbH (DE) | 2013-05-08 | — | — | EP | disclosed |
| WO-2012000632-A1 | PYRAZOLO-QUINOLINES | MERCK PATENT GMBH (DE) | 2012-01-05 | — | — | WO | disclosed |