Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | CNR1 | P21554 | 9/20 | 0.50 |
| ▸ | CNR2 | P34972 | 8/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.50 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8275514 | 0.91 | HPGD (0.56) | HPGDKDM4EHTTCNR1CNR2 | |
| SCHEMBL10259566 | 0.89 | HPGD (0.54) | HPGDKDM4EHTTCNR1CNR2 | |
| SCHEMBL10259752 | 0.87 | NPSR1 (0.62) | HPGDKDM4EHTTCNR1CNR2 | |
| SCHEMBL10259864 | 0.86 | NPSR1 (0.64) | HPGDKDM4EHTTCNR1CNR2 | |
| SCHEMBL10261683 | 0.86 | NPSR1 (0.64) | HPGDKDM4EHTTCNR1CNR2 | |
| SCHEMBL10261057 | 0.86 | CNR1 (0.53) | HPGDKDM4EHTTCNR1CNR2 | |
| SCHEMBL10259787 | 0.86 | LMNA (0.54) | HPGDKDM4EHTTCNR1CNR2 | |
| SCHEMBL10259601 | 0.86 | NR2F2 (0.64) | HPGDKDM4EHTTCNR1CNR2 | |
| SCHEMBL10261700 | 0.86 | HPGD (0.52) | HPGDKDM4EHTTCNR1CNR2 | |
| SCHEMBL8276985 | 0.85 | KMT2A (0.54) | HPGDKDM4EHTTCNR1CNR2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1776106-B1 | HETEROCYCLIC DERIVATIVES FOR MODULATION OF CALCIUM CHANNELS | VERTEX PHARMA (US) | 2013-08-07 | — | — | EP | disclosed |
| EP-1776106-A1 | HETEROCYCLIC DERIVATIVES FOR MODULATION OF CALCIUM CHANNELS | Vertex Pharmaceuticals Incorporated (US) | 2007-04-25 | — | — | EP | disclosed |
| WO-2006010008-A1 | HETEROCYCLIC DERIVATIVES FOR MODULATION OF CALCIUM CHANNELS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2006-01-26 | — | — | WO | disclosed |