Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 6/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | DRD2 | P14416 | 7/20 | 0.49 |
| ▸ | DRD4 | P21917 | 4/20 | 0.49 |
| ▸ | DRD3 | P35462 | 3/20 | 0.49 |
| ▸ | HTR2A | P28223 | 3/20 | 0.49 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.49 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.49 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.49 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.49 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.49 |
| ▸ | DRD1 | P21728 | 2/20 | 0.49 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL9231220 | 0.95 | KMT2A (0.53) | HTR1AALDH1A1KDM4EMAPTMAPK1 | |
| SCHEMBL9226276 | 0.89 | ALDH1A1 (0.52) | HTR1AALDH1A1KDM4EMAPTDRD2 | |
| SCHEMBL9223178 | 0.84 | TSHR (0.54) | HTR1AALDH1A1MAPTMAPK1CYP1A2 | |
| SCHEMBL9224859 | 0.82 | DRD2 (0.49) | HTR1AALDH1A1KDM4EMAPTMAPK1 | |
| SCHEMBL9230359 | 0.81 | ADRA1A (0.49) | HTR1AALDH1A1KDM4EMAPTCYP1A2 | |
| SCHEMBL9559588 | 0.81 | NPC1 (0.55) | ALDH1A1KDM4EMAPTCYP3A4DRD2 | |
| SCHEMBL9224851 | 0.80 | ALDH1A1 (0.50) | ALDH1A1KDM4EMAPTCYP3A4KMT2A | |
| SCHEMBL9225187 | 0.80 | ALDH1A1 (0.47) | HTR1AALDH1A1KDM4EMAPTDRD2 | |
| SCHEMBL9230859 | 0.80 | HTR1A (0.47) | HTR1AALDH1A1KDM4EMAPTMAPK1 | |
| SCHEMBL9559600 | 0.79 | KCNH2 (0.51) | HTR1AALDH1A1KDM4EMAPTDRD2 |
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-0544765-B1 | Piperazinyl derivatives with affinity for 5-HT receptors | NOVO NORDISK AS (DK) | 1995-08-02 | — | — | EP | disclosed |
| US-5246935-A | Cardiovascular and gastrointestinal | NOVO NORDISK A/S (DK) | 1993-09-21 | — | — | US | disclosed |
| EP-0544765-A1 | PIPERAZINYL DERIVATIVES. | NOVO NORDISK AS (DK) | 1993-06-09 | — | — | EP | disclosed |
| WO-1992003426-A1 | PIPERAZINYL DERIVATIVES | NOVO NORDISK A/S (DK) | 1992-03-05 | — | — | WO | disclosed |