Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.41 |
| ▸ | CACNA1F | O60840 | 2/20 | 0.40 |
| ▸ | CACNA1D | Q01668 | 2/20 | 0.40 |
| ▸ | CACNA1S | Q13698 | 2/20 | 0.40 |
| ▸ | CACNA1C | Q13936 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 4/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | MET | P08581 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 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 | |
|---|---|---|---|---|
| SCHEMBL16178473 | 0.82 | MET (0.49) | KDM4EGAATSHRNPSR1CACNA1F | |
| SCHEMBL11752122 | 0.80 | KDM4E (0.50) | KDM4EGAATSHRNPSR1CACNA1F | |
| SCHEMBL11749151 | 0.77 | KDM4E (0.41) | KDM4EGAATSHRNPSR1LMNA | |
| SCHEMBL11749794 | 0.77 | KDM4E (0.37) | KDM4EGAATSHRNPSR1LMNA | |
| SCHEMBL14987377 | 0.76 | TSHR (0.67) | KDM4EGAATSHRNPSR1CACNA1F | |
| SCHEMBL11752310 | 0.75 | ALDH1A1 (0.57) | KDM4EGAATSHRNPSR1MAPT | |
| SCHEMBL11754353 | 0.74 | CACNA1C (0.43) | KDM4EGAATSHRCACNA1FCACNA1D | |
| SCHEMBL11751454 | 0.71 | CACNA1B (0.53) | CACNA1FCACNA1DCACNA1SCACNA1C | |
| SCHEMBL11749717 | 0.69 | CACNA1F (0.62) | TSHRCACNA1FCACNA1DCACNA1SCACNA1C | |
| SCHEMBL11752019 | 0.69 | POLB (0.34) | KDM4EGAATSHRNPSR1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-4048171-A | 1,4-Dihydropyridines | BAYER AKTIENGESELLSCHAFT (DT) | 1977-09-13 | — | — | US | claimed |
| US-4048171-A | 1,4-Dihydropyridines | BAYER AKTIENGESELLSCHAFT (DT) | 1977-09-13 | — | — | US | disclosed |