Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | PDE10A | Q9Y233 | 3/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.50 |
| ▸ | PRNP | P04156 | 2/20 | 0.50 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | PARP1 | P09874 | 1/20 | 0.49 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.48 |
| ▸ | BACE1 | P56817 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| Iodide SCHEMBL29490766 | 0.81 | CYP1A2 (0.53) | KDM4EALDH1A1PDE10APRNPRXFP1 | |
| SCHEMBL13777688 | 0.80 | KDM4E (0.62) | KDM4EALDH1A1PDE10ACYP1A2POLB | |
| SCHEMBL31130638 | 0.79 | MAPT (0.61) | KDM4EPRNPRXFP1TSHRNPSR1 | |
| SCHEMBL27641245 | 0.79 | CYP1A2 (0.55) | KDM4EALDH1A1PDE10ACYP1A2CYP2C9 | |
| SCHEMBL21848526 | 0.79 | PDE10A (0.57) | KDM4EALDH1A1PDE10ACYP1A2POLB | |
| SCHEMBL526457 | 0.78 | CYP1A2 (0.58) | KDM4EALDH1A1PDE10APRNPRXFP1 | |
| SCHEMBL31434350 | 0.78 | NPFFR1 (0.55) | KDM4EALDH1A1PRNPRXFP1CYP1A2 | |
| SCHEMBL8671753 | 0.78 | CYP1A2 (0.53) | KDM4EALDH1A1PDE10ATSHRCYP1A2 | |
| SCHEMBL3969032 | 0.76 | CYP1A2 (0.60) | KDM4EALDH1A1PDE10ACYP1A2POLB | |
| SCHEMBL25523587 | 0.76 | CYP1A2 (0.51) | KDM4EALDH1A1PDE10ATSHRCYP1A2 |
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-0805870-A4 | SPECTROSCOPICALLY DETECTABLE NUCLEIC ACID LIGANDS | NEXSTAR PHARMACEUTICALS INC (US) | 2004-08-18 | — | — | EP | disclosed |
| EP-0805870-A1 | SPECTROSCOPICALLY DETECTABLE NUCLEIC ACID LIGANDS | NeXstar Pharmaceuticals, Inc. (US) | 1997-11-12 | — | — | EP | disclosed |
| WO-1996022383-A1 | SPECTROSCOPICALLY DETECTABLE NUCLEIC ACID LIGANDS | NEXSTAR PHARMACEUTICALS, INC. (US) | 1996-07-25 | — | — | WO | disclosed |