Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 3/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | DRD1 | P21728 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.47 |
| ▸ | HTR6 | P50406 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL2886310 | 0.89 | HRH1 (0.54) | HRH1TAAR1CYP1A2CYP2D6CHRM2 | |
| SCHEMBL2752018 | 0.83 | SMN1; SMN2 (0.46) | HRH1TAAR1CYP1A2CYP2D6CHRM2 | |
| SCHEMBL29485678 | 0.79 | HRH1 (0.73) | HRH1TAAR1CYP1A2CYP2D6HRH3 | |
| SCHEMBL230753 | 0.79 | HRH1 (0.73) | HRH1TAAR1CYP1A2CYP2D6HRH3 | |
| SCHEMBL28425160 | 0.79 | TAAR1 (0.44) | HRH1TAAR1CYP1A2CYP2D6ADRA2A | |
| SCHEMBL17997542 | 0.77 | CHRM2 (0.51) | CYP1A2CYP2D6CHRM2KDM4EMEN1 | |
| Bromide SCHEMBL28641396 | 0.77 | HRH1 (0.70) | HRH1TAAR1CYP1A2CYP2D6HRH3 | |
| SCHEMBL2030841 | 0.77 | TAAR1 (0.71) | TAAR1ADRA2AADRA2BHTR2BHRH3 | |
| SCHEMBL10573579 | 0.76 | SMN1; SMN2 (0.48) | CYP1A2KDM4ESMN1; SMN2ESR1POLB | |
| SCHEMBL17640379 | 0.76 | SMN1; SMN2 (0.51) | HRH1CYP1A2CYP2D6CHRM2CHRM5 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111499558-A | Asymmetric reduction method for chiral spiro-bisboron catalyzed substituted pyridine and application thereof | 南开大学 | 2020-08-07 | — | — | CN | disclosed |
| US-8932976-B2 | Preparation of catalyst for bisphenols production | DOW GLOBAL TECHNOLOGIES LLC (US) | 2015-01-13 | — | — | US | disclosed |
| US-20100152028-A1 | PREPARATION OF CATALYST FOR BISPHENOLS PRODUCTION | DOW GLOBAL TECHNOLOGIES LLC | 2010-06-17 | — | — | US | disclosed |