Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 4/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | DRD1 | P21728 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Dipenine SCHEMBL25069 | 0.98 | CHRM1 (0.43) | CHRM1CHRM2CHRM3EPHX1CYP3A4 | |
| Penoctonium SCHEMBL29388602 | 0.87 | TSHR (0.40) | EPHX1TSHR | |
| Penoctonium SCHEMBL2734618 | 0.86 | DNM1 (0.41) | EPHX1CYP3A4TSHRALDH1A1 | |
| SCHEMBL28324316 | 0.76 | TSHR (0.47) | CHRM1CHRM2EPHX1CYP3A4SLC6A3 | |
| SCHEMBL16352924 | 0.76 | ALDH1A1 (0.44) | CHRM1CHRM2CHRM3ALDH1A1 | |
| SCHEMBL16352894 | 0.75 | ALDH1A1 (0.46) | CHRM1CHRM2CHRM3SLC6A3KCNH2 | |
| SCHEMBL7537185 | 0.74 | EPHX1 (0.44) | CHRM1CHRM2EPHX1CYP3A4SLC6A3 | |
| SCHEMBL16352904 | 0.72 | CHRM1 (0.53) | CHRM1CHRM2CHRM3TSHRHTR1A | |
| SCHEMBL26311451 | 0.71 | EPHX1 (0.41) | EPHX1TSHRTHRBATML3MBTL1 | |
| SCHEMBL17189686 | 0.71 | CHRM2 (0.39) | CHRM1CHRM2CHRM3CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220047505-A1 | Controlled Absorption Water-Soluble Pharmaceutically Active Organic Compound Formulation for Once-Daily Administration | STI PHARMA, LLC (US) | 2022-02-17 | — | — | US | disclosed |