Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4C | Q08493 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 2/20 | 0.41 |
| ▸ | HTR2C | P28335 | 2/20 | 0.41 |
| ▸ | HTR2B | P41595 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 2/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL15210548 | 0.88 | PDE4C (0.37) | PDE4CHTR2AHTR2CHTR2BKDM4E | |
| SCHEMBL723374 | 0.85 | PDE4C (0.39) | PDE4CCYP1A2CYP1A1CYP1B1BRD4 | |
| SCHEMBL721309 | 0.83 | PDE4C (0.47) | PDE4CCYP1A2CYP1A1CYP1B1BRD4 | |
| SCHEMBL723398 | 0.82 | CALCRL (0.50) | PDE4CCYP1A2CYP3A4CYP1A1CYP1B1 | |
| SCHEMBL723093 | 0.81 | PDE4C (0.55) | PDE4CKDM4ECYP1A2CYP3A4CYP1A1 | |
| SCHEMBL15210399 | 0.81 | KDM4E (0.48) | PDE4CHTR2AHTR2CHTR2BKDM4E | |
| SCHEMBL16429216 | 0.80 | PDE4C (0.40) | PDE4CKDM4ECYP1A2CYP3A4CYP1A1 | |
| SCHEMBL15210645 | 0.80 | PDE4C (0.40) | PDE4CKDM4ECYP1A2CYP3A4CYP1A1 | |
| SCHEMBL723977 | 0.80 | CFTR (0.42) | KDM4EBRD4LMNAMEN1KMT2A | |
| SCHEMBL725317 | 0.80 | FYN (0.45) | PDE4CCYP1A2CYP3A4CYP1A1CYP1B1 |
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-2817313-A1 | FUROPYRIDINE DERIVATIVES | Merck Patent GmbH (DE) | 2014-12-31 | — | — | EP | disclosed |
| WO-2013124025-A1 | FUROPYRIDINE DERIVATIVES | MERCK PATENT GMBH (DE) | 2013-08-29 | — | — | WO | disclosed |