Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10488789 | 0.97 | CYP1A2 (0.48) | HTR1ACYP2C19CYP1A2CYP2D6ALDH1A1 | |
| SCHEMBL9691023 | 0.80 | MGAM (0.53) | HTR1AALDH1A1GAA | |
| SCHEMBL4960591 | 0.78 | CYP2C19 (0.59) | HTR1ACYP2C19CYP1A2CYP2D6ALDH1A1 | |
| SCHEMBL4962109 | 0.78 | CYP1A2 (0.58) | HTR1ACYP2C19CYP1A2CYP2D6ALDH1A1 | |
| SCHEMBL8395124 | 0.77 | GSTP1 (0.50) | CYP2C19CYP1A2ALDH1A1POLBMEN1 | |
| SCHEMBL8398603 | 0.77 | ERN1 (0.46) | ALDH1A1MEN1GAAKMT2A | |
| SCHEMBL8399950 | 0.77 | ERN1 (0.46) | ALDH1A1MEN1GAAKMT2A | |
| SCHEMBL4960929 | 0.73 | MAPT (0.53) | HTR1ACYP2C19CYP1A2CYP2D6ALDH1A1 | |
| SCHEMBL4963360 | 0.73 | MAPT (0.53) | HTR1ACYP2C19CYP1A2CYP2D6ALDH1A1 | |
| SCHEMBL7278367 | 0.72 | CYP3A4 (0.49) | ALDH1A1POLBMEN1KMT2ACYP3A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0276552-A1 | 1,4-dihydropyridine derivatives and their production | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1988-08-03 | — | — | EP | claimed |
| US-5039674-A | Calcium antagonistics | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1991-08-13 | — | — | US | disclosed |
| US-4782160-A | CALCIUM RECEPTOR ANTAGONISTS | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1988-11-01 | — | — | US | disclosed |
| EP-0276552-A1 | 1,4-dihydropyridine derivatives and their production | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1988-08-03 | — | — | EP | disclosed |