Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.57 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.50 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.48 |
| ▸ | DRD3 | P35462 | 3/20 | 0.48 |
| ▸ | DRD2 | P14416 | 2/20 | 0.48 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.48 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.47 |
| ▸ | DRD1 | P21728 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | CNR2 | P34972 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11129490 | 0.93 | KCNH2 (0.61) | KCNH2SIGMAR1OPRM1DRD3CHRM2 | |
| SCHEMBL4594295 | 0.93 | KCNH2 (0.61) | KCNH2SIGMAR1OPRM1DRD3CHRM2 | |
| SCHEMBL514689 | 0.93 | KCNH2 (0.61) | KCNH2SIGMAR1OPRM1DRD3CHRM2 | |
| SCHEMBL29064782 | 0.93 | KCNH2 (0.57) | KCNH2SIGMAR1OPRM1DRD3DRD2 | |
| SCHEMBL9116425 | 0.93 | KCNH2 (0.61) | KCNH2SIGMAR1OPRM1DRD3CHRM2 | |
| SCHEMBL9116373 | 0.93 | KCNH2 (0.61) | KCNH2SIGMAR1OPRM1DRD3CHRM2 | |
| SCHEMBL9117626 | 0.92 | KCNH2 (0.58) | KCNH2SIGMAR1OPRM1DRD3CHRM2 | |
| SCHEMBL28174361 | 0.90 | KCNH2 (0.57) | KCNH2SIGMAR1OPRM1DRD3CHRM2 | |
| SCHEMBL60682 | 0.88 | NPC1 (0.53) | KCNH2SIGMAR1 | |
| SCHEMBL45379 | 0.88 | NPC1 (0.53) | KCNH2SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996012760-A2 | STABILIZED POLYETHER POLYOL AND POLYURETHANE FOAM OBTAINED THEREFROM | UNIROYAL CHEMICAL COMPANY, INC. (US) | 1996-05-02 | — | — | WO | disclosed |