Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | DRD1 | P21728 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.41 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30148102 | 0.86 | AKR1B10 (0.49) | ALDH1A1TSHRKMT2AAKR1B10AKR1A1 | |
| SCHEMBL28476647 | 0.77 | ABCB1 (0.50) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| SCHEMBL28473850 | 0.74 | CHRM2 (0.39) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| SCHEMBL28473847 | 0.74 | ABCB1 (0.47) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| SCHEMBL28464322 | 0.71 | HDAC6 (0.49) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| SCHEMBL28466018 | 0.71 | CHRM2 (0.48) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| SCHEMBL20635520 | 0.70 | HDAC6 (0.47) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| SCHEMBL11475239 | 0.68 | HDAC6 (0.44) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| SCHEMBL11485429 | 0.68 | HDAC6 (0.50) | CHRM2HTR1AADRA2ACHRM1DRD1 | |
| Hydrochloric Acid SCHEMBL11467829 | 0.67 | ALDH1A1 (0.43) | CHRM2HTR1AADRA2ACHRM1DRD1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111675725-B | Tetrahydro-beta-carbaline dimer and preparation method and application thereof | 中国药科大学 | 2023-01-24 | — | — | CN | disclosed |
| CN-111675725-A | Tetrahydro-beta-carbaline dimer and preparation method and application thereof | 中国药科大学 | 2020-09-18 | — | — | CN | disclosed |