Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.43 |
| ▸ | LSS | P48449 | 4/20 | 0.35 |
| ▸ | HTR1D | P28221 | 1/20 | 0.34 |
| ▸ | HTR1B | P28222 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 3/20 | 0.31 |
| ▸ | DRD3 | P35462 | 3/20 | 0.31 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.31 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.31 |
| ▸ | KDM5A | P29375 | 1/20 | 0.30 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27578301 | 0.98 | SIGMAR1 (0.41) | SIGMAR1LSSHTR1DHTR1BCYP1A2 | |
| SCHEMBL27581076 | 0.93 | HTR1D (0.35) | SIGMAR1HTR1DHTR1BCYP1A2DRD2 | |
| SCHEMBL14203281 | 0.76 | SIGMAR1 (0.42) | SIGMAR1HTR1DHTR1BCYP1A2CHRM2 | |
| SCHEMBL15124424 | 0.76 | CYP1A2 (0.56) | CYP1A2CHRM2DRD2DRD3 | |
| SCHEMBL27596289 | 0.74 | HTR1D (0.38) | SIGMAR1LSSHTR1DHTR1B | |
| SCHEMBL27579916 | 0.72 | DRD2 (0.31) | DRD2DRD3 | |
| SCHEMBL6064565 | 0.71 | ALDH1A1 (0.39) | CYP1A2CYP2C9 | |
| SCHEMBL19672260 | 0.71 | SIGMAR1 (0.56) | SIGMAR1CHRM2S1PR3S1PR2S1PR1 | |
| SCHEMBL27596425 | 0.70 | LSS (0.47) | SIGMAR1LSSHTR1DHTR1B | |
| SCHEMBL9417315 | 0.68 | SIGMAR1 (0.81) | SIGMAR1LSSCYP1A2CHRM2KDM5A |
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 |
|---|---|---|---|---|---|---|---|
| CN-1468214-A | Novel derivatives of aminocyclohexane | - | 2004-01-14 | — | — | CN | disclosed |