Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 7/20 | 0.35 |
| ▸ | CACNA1C | Q13936 | 5/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.34 |
| ▸ | LMNA | P02545 | 5/20 | 0.34 |
| ▸ | MEN1 | O00255 | 5/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.34 |
| ▸ | THPO | P40225 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | CACNA1F | O60840 | 3/20 | 0.34 |
| ▸ | CACNA1D | Q01668 | 3/20 | 0.34 |
| ▸ | CACNA1S | Q13698 | 3/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10995916 | 0.90 | KMT2A (0.42) | KMT2ACACNA1CCYP2C9CYP1A2CYP3A4 | |
| SCHEMBL7265677 | 0.85 | CYP2C9 (0.46) | KMT2ACACNA1CCYP2C9CYP1A2CYP3A4 | |
| SCHEMBL7264416 | 0.83 | CACNA1C (0.51) | KMT2ACACNA1CCYP2C9CYP1A2CYP3A4 | |
| SCHEMBL7271815 | 0.81 | MAPK1 (0.36) | KMT2ACYP2C9CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL7270521 | 0.80 | KMT2A (0.35) | KMT2ACACNA1CCYP2C9CYP1A2CYP3A4 | |
| SCHEMBL7265650 | 0.79 | ABCC1 (0.32) | CACNA1CCYP2C9CYP3A4CYP2C19TSHR | |
| SCHEMBL7273125 | 0.79 | LMNA (0.47) | KMT2ACACNA1CCYP2C9CYP1A2CYP3A4 | |
| SCHEMBL7263910 | 0.78 | POLB (0.41) | KMT2ACACNA1CCYP2C9CYP1A2CYP3A4 | |
| SCHEMBL7271627 | 0.77 | CYP2C9 (0.47) | KMT2ACACNA1CCYP2C9CYP1A2CYP3A4 | |
| SCHEMBL7265522 | 0.76 | CYP2C9 (0.42) | KMT2ACYP2C9CYP1A2CYP3A4CYP2C19 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0116708-A1 | Substituted 1,4-dihydropyridines, method for their preparation and their use as pharmaceuticals | CASSELLA Aktiengesellschaft (DE) | 1984-08-29 | — | — | EP | disclosed |