Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4D | Q08499 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | ILK | Q13418 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | DPP4 | P27487 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL23025720 | 0.80 | PDE4D (0.50) | PDE4DKDM4ETSHRPOLBMEN1 | |
| SCHEMBL7277080 | 0.79 | PDE4D (0.44) | PDE4DKDM4ETSHRPOLBMEN1 | |
| SCHEMBL1928112 | 0.79 | PDE4D (0.44) | PDE4DKDM4ETSHRPOLBMEN1 | |
| SCHEMBL5648877 | 0.79 | KDM4E (0.46) | PDE4DKDM4ETSHRPOLBMEN1 | |
| SCHEMBL11368014 | 0.77 | ALDH1A1 (0.50) | PDE4DKDM4ETSHRPOLBMEN1 | |
| SCHEMBL5906562 | 0.77 | PDE4D (0.43) | PDE4DKDM4ETSHRPOLBMEN1 | |
| SCHEMBL15897055 | 0.77 | PDE4D (0.43) | PDE4DKDM4ETSHRPOLBMEN1 | |
| SCHEMBL5648880 | 0.76 | KDM4E (0.47) | PDE4DKDM4ETSHRPOLBMEN1 | |
| SCHEMBL1412491 | 0.76 | PDE4D (0.42) | PDE4DKDM4ETSHRPOLBMEN1 | |
| SCHEMBL1930598 | 0.75 | PDE4D (0.41) | PDE4DKDM4ETSHRPOLBMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4142046-A | BACTERICIDES, 7-AMINO-CEPHALOSPORINS | SMITHKLINE CORPORATION (US) | 1979-02-27 | — | — | US | disclosed |
| US-4060610-A | Pharmaceutical compositions comprising 7-acyl-3-(substituted triazolyl thiomethyl)-cephalosporins and methods of treating bacterial infections | SMITHKLINE CORPORATION (US) | 1977-11-29 | — | — | US | disclosed |
| US-3989694-A | ANTIBACTERIAL | SMITHKLINE CORPORATION (US) | 1976-11-02 | — | — | US | disclosed |