Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIK1 | P39086 | 2/20 | 0.55 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.55 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.55 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.55 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.55 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.55 |
| ▸ | BRD4 | O60885 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.49 |
| ▸ | GRIK3 | Q13003 | 1/20 | 0.49 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | PARP1 | P09874 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18569112 | 0.87 | BRD4 (0.54) | GRIK1GRIA1GRIA2GRIA3GRIA4 | |
| SCHEMBL12049928 | 0.84 | BRD4 (0.57) | BRD4ALDH1A1HPGDTDP1GRM1 | |
| SCHEMBL31017191 | 0.83 | KDM4E (0.54) | HRH3BRD4ALDH1A1KDM4EHPGD | |
| SCHEMBL2806050 | 0.81 | KDM4E (0.63) | GRIK1GRIA1GRIA2GRIA3GRIA4 | |
| SCHEMBL29415468 | 0.81 | KDM4E (0.63) | GRIK1GRIA1GRIA2GRIA3GRIA4 | |
| SCHEMBL1105989 | 0.81 | HRH3 (0.59) | HRH3ALDH1A1KDM4ETHRBHPGD | |
| SCHEMBL16938458 | 0.80 | HRH3 (0.59) | HRH3BRD4ALDH1A1KDM4EHPGD | |
| SCHEMBL12301243 | 0.79 | BRD4 (0.46) | HRH3BRD4ALDH1A1KDM4EGRM1 | |
| SCHEMBL12301241 | 0.78 | BRD4 (0.49) | BRD4ALDH1A1KDM4EHPGDTDP1 | |
| SCHEMBL28979258 | 0.77 | BRD4 (0.59) | BRD4ALDH1A1KDM4EHPGDGRM1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1709012-B1 | 6-SUBSTITUTED 2-QUINOLINONES AND 2-QUINOXALINONES AS POLY(ADP-RIBOSE)POLYMERASE INHIBITORS | JANSSEN PHARMACEUTICA NV (BE) | 2015-07-29 | — | — | EP | disclosed |
| US-5591751-A | CARBOSTYRIL DERIVATIVES | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1997-01-07 | — | — | US | disclosed |
| CN-1102527-A | Piperazinocarbonylcarbostyrils as peripheral vasodilators | OTSUKA PHARMA CO LTD (JP) | 1995-05-10 | — | — | CN | disclosed |
| EP-0636128-A1 | PIPERAZINOCARBONYLCARBOSTYRILS AS PERIPHERAL VASODILATORS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1995-02-01 | — | — | EP | disclosed |
| WO-1994019339-A1 | PIPERAZINOCARBONYLCARBOSTYRILS AS PERIPHERAL VASODILATORS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1994-09-01 | — | — | WO | disclosed |