Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.46 |
| ▸ | IDO1 | P14902 | 2/20 | 0.46 |
| ▸ | AGXT | P21549 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.43 |
| ▸ | CMA1 | P23946 | 1/20 | 0.42 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | AOC3 | Q16853 | 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 | |
|---|---|---|---|---|
| SCHEMBL96382 | 0.86 | TAAR1 (0.60) | TAAR1IDO1AGXTCHRM2CHRM1 | |
| SCHEMBL29587500 | 0.86 | TAAR1 (0.60) | TAAR1IDO1AGXTCHRM2CHRM1 | |
| Cyclopropane SCHEMBL28787876 | 0.81 | TAAR1 (0.55) | TAAR1IDO1AGXTCHRM2CHRM1 | |
| SCHEMBL25980403 | 0.79 | TAAR1 (0.53) | TAAR1IDO1AGXTSMN1; SMN2CHRM2 | |
| SCHEMBL8785364 | 0.79 | TAAR1 (0.53) | TAAR1IDO1AGXTSMN1; SMN2CHRM2 | |
| SCHEMBL29092780 | 0.78 | ACHE (0.68) | TAAR1IDO1AGXTSMN1; SMN2CHRM2 | |
| (S)-M-Methoxyamphetamine SCHEMBL31545212 | 0.77 | TAAR1 (0.77) | TAAR1IDO1AGXTSIGMAR1 | |
| SCHEMBL4937029 | 0.76 | FYN (0.56) | TAAR1IDO1AGXTMTNR1BCYP1A2 | |
| SCHEMBL1956803 | 0.75 | KMT2A (0.55) | TAAR1IDO1AGXTCYP1A2 | |
| SCHEMBL126287 | 0.74 | TP53 (0.55) | TSHRSMN1; SMN2CHRM2CHRM1CHRM3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115260185-A | Deuterated derivatives of corydaline and stepholidine and preparation method thereof | 杨征 | 2022-11-01 | — | — | CN | disclosed |