Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.51 |
| ▸ | DRD3 | P35462 | 9/20 | 0.50 |
| ▸ | HTR1A | P08908 | 7/20 | 0.50 |
| ▸ | DRD2 | P14416 | 5/20 | 0.50 |
| ▸ | DRD4 | P21917 | 4/20 | 0.50 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.50 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.50 |
| ▸ | HTR2A | P28223 | 5/20 | 0.49 |
| ▸ | HTR2C | P28335 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7546771 | 1.00 | HDAC6 (0.51) | HDAC6DRD3HTR1ADRD2DRD4 | |
| SCHEMBL7549507 | 1.00 | HDAC6 (0.51) | HDAC6DRD3HTR1ADRD2DRD4 | |
| SCHEMBL7547379 | 1.00 | HDAC6 (0.51) | HDAC6DRD3HTR1ADRD2DRD4 | |
| SCHEMBL7544286 | 1.00 | HDAC6 (0.51) | HDAC6DRD3HTR1ADRD2DRD4 | |
| SCHEMBL7548431 | 0.95 | HDAC6 (0.52) | HDAC6DRD3HTR1ADRD2DRD4 | |
| SCHEMBL7547428 | 0.95 | HDAC6 (0.52) | HDAC6DRD3HTR1ADRD2DRD4 | |
| SCHEMBL7541200 | 0.95 | HDAC6 (0.52) | HDAC6DRD3HTR1ADRD2DRD4 | |
| SCHEMBL7546434 | 0.95 | HDAC6 (0.52) | HDAC6DRD3HTR1ADRD2DRD4 | |
| SCHEMBL7548641 | 0.95 | HDAC6 (0.52) | HDAC6DRD3HTR1ADRD2DRD4 | |
| SCHEMBL7549212 | 0.92 | DRD3 (0.50) | HDAC6DRD3HTR1ADRD2DRD4 |
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-0885886-B1 | PYRIDINECARBOXAMIDE DERIVATIVES | NISSHIN SEIFUN GROUP INC (JP) | 2002-05-29 | — | — | EP | disclosed |
| US-5972943-A | N-(NITRIC ACID,C14-18 ALKYL ESTER)-6-(1-(OPTIONALLY 4-SUBSTITUTED PIPERAZINYL)) PYRIDINE-3-CARBOXAMIDES; METHOD OF SYNTHESIS; ADMINISTERING TO TREAT CEREBRAL EDEMA; NO HYPOTENSIVE SIDE EFFECT | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1999-10-26 | — | — | US | disclosed |
| EP-0885886-A1 | NOVEL PYRIDINECARBOXAMIDE DERIVATIVES | Nisshin Flour Milling Co., Ltd. (JP) | 1998-12-23 | — | — | EP | disclosed |