Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 6/20 | 0.46 |
| ▸ | GRIN2A | Q12879 | 6/20 | 0.46 |
| ▸ | GRIN2D | O15399 | 5/20 | 0.46 |
| ▸ | GRIN2C | Q14957 | 5/20 | 0.46 |
| ▸ | GRIN2B | Q13224 | 4/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.46 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.46 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.46 |
| ▸ | DRD4 | P21917 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.46 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.46 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.46 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.46 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.46 |
| ▸ | MRGPRX2 | Q96LB1 | 1/20 | 0.46 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.45 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8551678 | 0.74 | HTR2A (0.47) | CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL20484039 | 0.73 | CHRNB2 (0.49) | GRIN1GRIN2AGRIN2DGRIN2CGRIN2B | |
| SCHEMBL75391 | 0.72 | ALDH1A1 (0.72) | OPRM1DRD4DRD3ALDH1A1ESR1 | |
| SCHEMBL2095353 | 0.70 | CYP3A4 (0.53) | KCNH2ALDH1A1ESR1CYP3A4ESR2 | |
| SCHEMBL27757219 | 0.69 | GRIN1 (0.46) | GRIN1GRIN2AGRIN2DGRIN2CGRIN2B | |
| SCHEMBL10439905 | 0.69 | GRIN1 (0.52) | GRIN1GRIN2AGRIN2DGRIN2CGRIN2B | |
| SCHEMBL8658460 | 0.68 | GRIN1 (0.55) | GRIN1GRIN2AGRIN2DGRIN2CGRIN2B | |
| SCHEMBL8698880 | 0.67 | ALDH1A1 (0.50) | ALDH1A1ESR1CYP3A4ESR2 | |
| SCHEMBL11140237 | 0.67 | GRIN2D (0.41) | GRIN1GRIN2AGRIN2DGRIN2CGRIN2B | |
| SCHEMBL11715175 | 0.66 | CYP2C19 (0.59) | OPRM1DRD3ALDH1A1ESR1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0827502-A1 | METHADONE DERIVATIVES AND PROTEIN AND POLYPEPTIDE METHADONE DERIVATIVE CONJUGATES AND LABELS | BIOSITE DIAGNOSTICS INC. (US) | 1998-03-11 | — | — | EP | disclosed |
| WO-1996031496-A1 | METHADONE DERIVATIVES AND PROTEIN AND POLYPEPTIDE METHADONE DERIVATIVE CONJUGATES AND LABELS | BIOSITE DIAGNOSTICS, INCORPORATED (US) | 1996-10-10 | — | — | WO | disclosed |