Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.65 |
| ▸ | HRH1 | P35367 | 4/20 | 0.56 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.56 |
| ▸ | HTR3A | P46098 | 1/20 | 0.52 |
| ▸ | TNF | P01375 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | PDE6D | O43924 | 1/20 | 0.50 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.50 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.50 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.49 |
| ▸ | OGFRL1 | Q5TC84 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28901292 | 1.00 | TAAR1 (0.65) | TAAR1HRH1CHRM1HTR3ATNF | |
| SCHEMBL29597271 | 1.00 | TAAR1 (0.65) | TAAR1HRH1CHRM1HTR3ATNF | |
| SCHEMBL3870973 | 0.88 | TAAR1 (0.55) | TAAR1HRH1CHRM1KCNH2 | |
| SCHEMBL3864781 | 0.86 | TAAR1 (0.55) | TAAR1HRH1CHRM1CYP2D6OPRL1 | |
| SCHEMBL15244750 | 0.85 | TAAR1 (0.48) | TAAR1HRH1CHRM1ALDH1A1LMNA | |
| SCHEMBL10476244 | 0.84 | HRH1 (0.54) | TAAR1HRH1CHRM1HTR3ATNF | |
| SCHEMBL3866014 | 0.82 | DRD2 (0.57) | TAAR1HRH1CHRM1LMNA | |
| SCHEMBL28901274 | 0.80 | TAAR1 (0.67) | TAAR1HRH1CHRM1OPRL1OGFRL1 | |
| SCHEMBL29596376 | 0.80 | TAAR1 (0.67) | TAAR1HRH1CHRM1OPRL1OGFRL1 | |
| SCHEMBL28901279 | 0.80 | TAAR1 (0.67) | TAAR1HRH1CHRM1OPRL1OGFRL1 |
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-114349781-A | Chiral pyrrolidine skeleton-containing aminophenoxy zinc complex and preparation method and application thereof | 华东理工大学 | 2022-04-15 | — | — | CN | disclosed |