Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Clebopride. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 known ✓ | P14416 | 7/20 | 0.98 |
| ▸ | HTR4 known ✓ | Q13639 | 6/20 | 0.74 |
| ▸ | DRD4 | P21917 | 8/20 | 0.98 |
| ▸ | DRD3 | P35462 | 6/20 | 0.98 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.98 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.98 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.98 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.98 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.98 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.98 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.98 |
| ▸ | ACHE | P22303 | 1/20 | 0.98 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.98 |
| ▸ | HTR2A | P28223 | 1/20 | 0.98 |
| ▸ | HTR2C | P28335 | 1/20 | 0.98 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.98 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.98 |
| ▸ | HTR2B | P41595 | 1/20 | 0.98 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.98 |
| ▸ | HTR3A | P46098 | 1/20 | 0.98 |
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 | |
|---|---|---|---|---|
| Clebopride SCHEMBL25710 | 0.99 | DRD4 (1.00) | DRD4DRD2DRD3CYP3A4CYP1A2 | |
| Clebopride SCHEMBL25259199 | 0.99 | DRD4 (1.00) | DRD4DRD2DRD3CYP3A4CYP1A2 | |
| SCHEMBL11533888 | 0.95 | DRD4 (0.92) | DRD4DRD2DRD3CYP3A4CYP1A2 | |
| Clebopride SCHEMBL2323732 | 0.94 | CYP3A4 (1.00) | DRD4DRD2DRD3CYP3A4CYP1A2 | |
| Clebopride SCHEMBL2323725 | 0.94 | CYP3A4 (1.00) | DRD4DRD2DRD3CYP3A4CYP1A2 | |
| Clebopride SCHEMBL4537448 | 0.94 | CYP3A4 (1.00) | DRD4DRD2DRD3CYP3A4CYP1A2 | |
| SCHEMBL11472928 | 0.93 | DRD4 (1.00) | DRD4DRD2DRD3CYP3A4CYP1A2 | |
| Clebopride SCHEMBL3701285 | 0.90 | DRD4 (0.83) | DRD4DRD2DRD3CYP3A4CYP1A2 | |
| SCHEMBL14454215 | 0.88 | DRD4 (0.80) | DRD4DRD2DRD3CYP3A4CYP1A2 | |
| SCHEMBL11463635 | 0.88 | DRD4 (1.00) | DRD4DRD2DRD3CYP3A4CYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5026858-A | Used for treating nausea, vomating, gastrointestinal disorders and centarl nervous system | WALTON S.A. (ES) | 1991-06-25 | — | — | US | disclosed |
| US-4367232-A | ANOREXIGENIC AGENTS,ANESTHETICS | FORDONAL, S.A. (ES) | 1983-01-04 | — | — | US | disclosed |