Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR4 | Q13639 | 5/20 | 0.80 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.80 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.80 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.80 |
| ▸ | DRD3 | P35462 | 3/20 | 0.80 |
| ▸ | DRD2 | P14416 | 3/20 | 0.80 |
| ▸ | LMNA | P02545 | 3/20 | 0.80 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.80 |
| ▸ | HTR3A | P46098 | 2/20 | 0.80 |
| ▸ | HTR2B | P41595 | 2/20 | 0.80 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.80 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.80 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.80 |
| ▸ | HTR3B | O95264 | 1/20 | 0.80 |
| ▸ | MPO | P05164 | 1/20 | 0.80 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.80 |
| ▸ | DRD4 | P21917 | 1/20 | 0.80 |
| ▸ | HTR2A | P28223 | 1/20 | 0.80 |
| ▸ | HTR2C | P28335 | 1/20 | 0.80 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.80 |
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 | |
|---|---|---|---|---|
| SCHEMBL9777127 | 0.90 | HTR4 (0.79) | HTR4CYP2D6CYP1A2ADRA2ADRD3 | |
| SCHEMBL9777134 | 0.90 | HTR4 (0.76) | HTR4CYP2D6CYP1A2ADRA2ADRD3 | |
| SCHEMBL9777097 | 0.90 | HTR4 (0.76) | HTR4CYP2D6CYP1A2ADRA2ADRD3 | |
| SCHEMBL9777166 | 0.90 | HTR4 (0.76) | HTR4CYP2D6CYP1A2ADRA2ADRD3 | |
| Metoclopramide SCHEMBL18629 | 0.89 | HTR4 (1.00) | HTR4CYP2D6CYP1A2ADRA2ADRD3 | |
| Metoclopramide SCHEMBL27855472 | 0.89 | HTR4 (1.00) | HTR4CYP2D6CYP1A2ADRA2ADRD3 | |
| Metoclopramide SCHEMBL28222039 | 0.89 | HTR4 (1.00) | HTR4CYP2D6CYP1A2ADRA2ADRD3 | |
| SCHEMBL9777123 | 0.89 | CYP2D6 (0.74) | HTR4CYP2D6CYP1A2ADRA2ADRD3 | |
| SCHEMBL9777161 | 0.89 | HTR4 (0.78) | HTR4CYP2D6CYP1A2ADRA2ADRD3 | |
| SCHEMBL9570884 | 0.89 | CYP2D6 (0.74) | HTR4CYP2D6CYP1A2ADRA2ADRD3 |
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-1771408-A4 | METHOD FOR PREPARING 4-[2-(DIMETHYLAMINO)ETHOXY]BENZYLAMINE AS ITOPRIDE HYDROCLORIDE SALT MEDIATE | IL YANG PHARM CO LTD (KR) | 2007-08-29 | — | — | EP | disclosed |
| EP-1771408-A1 | METHOD FOR PREPARING 4-[2-(DIMETHYLAMINO)ETHOXY]BENZYLAMINE AS ITOPRIDE HYDROCLORIDE SALT MEDIATE | Il Yang Pharm. Co. Ltd. (KR) | 2007-04-11 | — | — | EP | disclosed |
| WO-2006011696-A1 | METHOD FOR PREPARING 4-[2-(DIMETHYLAMINO)ETHOXY]BENZYLAMINE AS ITOPRIDE HYDROCLORIDE SALT MEDIATE | IL YANG PHARM. CO., LTD (KR) | 2006-02-02 | — | — | WO | disclosed |