Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 20/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 2/20 | 0.39 |
| ▸ | DRD3 | P35462 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8327701 | 0.95 | DRD4 (0.48) | DRD4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8326767 | 0.90 | DRD4 (0.47) | DRD4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8330688 | 0.90 | DRD4 (0.47) | DRD4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8322798 | 0.86 | DRD4 (0.48) | DRD4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8329132 | 0.85 | DRD4 (0.47) | DRD4CYP1A2CYP3A4CYP2C9DRD3 | |
| SCHEMBL8325130 | 0.85 | DRD4 (0.47) | DRD4CYP1A2CYP3A4CYP2C9DRD3 | |
| SCHEMBL8327784 | 0.85 | DRD4 (0.43) | DRD4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8327781 | 0.85 | DRD4 (0.43) | DRD4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8323338 | 0.85 | DRD4 (0.43) | DRD4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8324232 | 0.84 | DRD4 (0.46) | DRD4CYP1A2CYP3A4CYP2C9DRD3 |
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-0966443-A1 | HETEROARYL-HEXANOIC ACID AMIDE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS SELECTIVE INHIBITORS OF MIP-1-ALPHA BINDING TO ITS CCR1 RECEPTOR | PFIZER INC. (US) | 1999-12-29 | — | — | EP | disclosed |
| EP-0760368-B1 | PYRIMIDINE DERIVATIVES | NISSHIN FLOUR MILLING CO (JP) | 1999-07-28 | — | — | EP | disclosed |
| WO-1998038167-A1 | HETEROARYL-HEXANOIC ACID AMIDE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS SELECTIVE INHIBITORS OF MIP-1-ALPHA BINDING TO ITS CCR1 RECEPTOR | PFIZER INC. (US) | 1998-09-03 | — | — | WO | disclosed |
| US-5736550-A | TREATMENT OF GASTROINTESTINAL TRACT DISORDERS | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1998-04-07 | — | — | US | disclosed |
| EP-0760368-A1 | NOVEL PYRIMIDINE DERIVATIVE | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1997-03-05 | — | — | EP | disclosed |