Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.57 |
| ▸ | HTR2A | P28223 | 2/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.47 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.45 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Propane SCHEMBL8092945 | 0.82 | MAOA (0.74) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 | |
| SCHEMBL7765754 | 0.82 | IDO1 (0.44) | MAOASIGMAR1IDO1 | |
| Benzene SCHEMBL28170833 | 0.80 | MAOA (0.85) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 | |
| SCHEMBL52482 | 0.80 | MAOA (0.85) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 | |
| Ammonia Solution, Strong SCHEMBL7296242 | 0.78 | MAOA (0.81) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 | |
| Iodide SCHEMBL6672340 | 0.78 | MAOA (0.81) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 | |
| Bromide SCHEMBL5311946 | 0.78 | MAOA (0.81) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 | |
| Hydrochloric Acid SCHEMBL1551608 | 0.78 | MAOA (0.81) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 | |
| Water SCHEMBL28661260 | 0.78 | MAOA (0.81) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 | |
| SCHEMBL27510111 | 0.78 | MAOA (0.81) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 |
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-105727908-A | Magnetic adsorbent with function of adsorbing radioactive element and preparation method thereof | 环境保护部核与辐射安全中心 | 2016-07-06 | — | — | CN | disclosed |