Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 1/20 | 0.64 |
| ▸ | HTR7 | P34969 | 8/20 | 0.56 |
| ▸ | CHRM4 | P08173 | 5/20 | 0.55 |
| ▸ | CTSK | P43235 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | DRD2 | P14416 | 3/20 | 0.52 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.51 |
| ▸ | HTR2A | P28223 | 4/20 | 0.51 |
| ▸ | HTR2C | P28335 | 3/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL10857696 | 0.86 | GRIN2B (0.67) | GRIN2BHTR7CHRM4CTSKCYP3A4 | |
| SCHEMBL10851304 | 0.85 | GRIN2B (0.66) | GRIN2BHTR7CHRM4CTSKCYP3A4 | |
| SCHEMBL14892998 | 0.85 | GRIN2B (0.62) | GRIN2BHTR7CHRM4CTSKCYP3A4 | |
| Hydrochloric Acid SCHEMBL10851253 | 0.85 | GRIN2B (0.66) | GRIN2BHTR7CHRM4CTSKCYP3A4 | |
| Hydrochloric Acid SCHEMBL10854412 | 0.84 | GRIN2B (0.64) | GRIN2BHTR7CHRM4CTSKCYP3A4 | |
| SCHEMBL928865 | 0.81 | GRIN2B (0.57) | GRIN2BHTR7CHRM4CTSKCYP3A4 | |
| SCHEMBL18087743 | 0.81 | GRIN2B (0.76) | GRIN2BHTR7CHRM4CTSKCYP3A4 | |
| SCHEMBL5532807 | 0.80 | GRIN2B (0.70) | GRIN2BHTR7CHRM4CTSKCYP3A4 | |
| SCHEMBL21883968 | 0.80 | GRIN2B (0.70) | GRIN2BHTR7CHRM4CTSKCYP3A4 | |
| SCHEMBL8322968 | 0.80 | GRIN2B (0.70) | GRIN2BHTR7CHRM4CTSKCYP3A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-57028087-A | — | — | None | — | — | JP | disclosed |
| JP-57028087-A | — | — | None | — | — | JP | disclosed |
| JP-S5728087-A | NOVEL 1-(3'-AMINOPROPYL)TETRAHYDRO-BETA-CARBOLINE COMPOUND AND ITS PREPARATION | KAWAKEN FINE CHEM CO LTD | 1982-02-15 | — | — | JP | disclosed |
| JP-S5728087-A | NOVEL 1-(3'-AMINOPROPYL)TETRAHYDRO-BETA-CARBOLINE COMPOUND AND ITS PREPARATION | KAWAKEN FINE CHEM CO LTD | 1982-02-15 | — | — | JP | disclosed |