Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 6/20 | 0.70 |
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.62 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.50 |
| ▸ | DRD3 | P35462 | 2/20 | 0.50 |
| ▸ | DRD2 | P14416 | 1/20 | 0.50 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.50 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.50 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.50 |
| ▸ | HTR1A | P08908 | 1/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.50 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.50 |
| ▸ | DRD1 | P21728 | 1/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.50 |
| ▸ | THRA | P10827 | 1/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29107066 | 0.85 | KCNH2 (0.86) | KCNH2SIGMAR1OPRM1DRD3DRD2 | |
| SCHEMBL11237058 | 0.85 | KCNH2 (0.86) | KCNH2SIGMAR1OPRM1DRD3DRD2 | |
| SCHEMBL14432408 | 0.85 | OPRM1 (0.51) | KCNH2SIGMAR1OPRM1DRD3DRD2 | |
| SCHEMBL11135856 | 0.85 | KCNH2 (0.86) | KCNH2SIGMAR1OPRM1DRD3DRD2 | |
| SCHEMBL11134742 | 0.85 | KCNH2 (0.86) | KCNH2SIGMAR1OPRM1DRD3DRD2 | |
| Chloromethane SCHEMBL28899368 | 0.85 | KCNH2 (0.67) | KCNH2SIGMAR1CHRM2ADRA2ACHRM1 | |
| Chloromethane SCHEMBL28633293 | 0.85 | KCNH2 (0.67) | KCNH2SIGMAR1CHRM2ADRA2ACHRM1 | |
| Chloromethane SCHEMBL28633169 | 0.85 | KCNH2 (0.67) | KCNH2SIGMAR1CHRM2ADRA2ACHRM1 | |
| Chloromethane SCHEMBL28642435 | 0.85 | KCNH2 (0.67) | KCNH2SIGMAR1CHRM2ADRA2ACHRM1 | |
| Chloromethane SCHEMBL28461681 | 0.85 | KCNH2 (0.67) | KCNH2SIGMAR1CHRM2ADRA2ACHRM1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5480779-A | ADDING TO SAMPLE PREDETERMINED AMOUNT OF ISOMERASE ISOMERIZING PEPTIDE N-TERMINAL TO PROLINE, MEASURING ENZYME-CATALYZED ISOMERIZATION OF PROLINE-CONTAINING PEPTIDE SUBSTRATE, DETERMINING CYCLOSPORIN CONCENTRATION FROM CALIBRATION CURVE | ARZNEIMITTELWERK DRESDEN GMBH (DE) | 1996-01-02 | — | — | US | disclosed |