Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 4/20 | 0.39 |
| ▸ | HTR7 | P34969 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL7328297 | 0.94 | GRIN1 (0.47) | CHRM2CHRM4OPRM1OPRD1OPRK1 | |
| SCHEMBL7335048 | 0.93 | GRIN1 (0.47) | GRIN1GRIN2B | |
| SCHEMBL7327816 | 0.92 | GRIN1 (0.47) | GRIN1GRIN2B | |
| SCHEMBL7329172 | 0.89 | HTR1A (0.41) | HTR1AHTR7 | |
| SCHEMBL7335621 | 0.87 | DRD2 (0.46) | CYP2D6HTR1AHTR7TSHRCYP1A2 | |
| SCHEMBL7328451 | 0.83 | DRD2 (0.45) | HTR1AHTR7 | |
| SCHEMBL7325610 | 0.82 | DRD2 (0.54) | GRIN1GRIN2BCYP2D6HTR1AHTR7 | |
| SCHEMBL7332672 | 0.82 | DRD2 (0.46) | HTR1AHTR7 | |
| SCHEMBL7333718 | 0.82 | DRD2 (0.46) | GRIN1GRIN2BCYP2D6TSHRCYP1A2 | |
| SCHEMBL7325098 | 0.81 | DRD2 (0.47) | HTR1AHTR7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0402923-A2 | 2,5-Diaminotetralines, process for their preparation and their use as medicine | BOEHRINGER INGELHEIM KG (DE) | 1990-12-19 | — | — | EP | disclosed |