Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 4/20 | 0.65 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | KDM1A | O60341 | 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 | |
|---|---|---|---|---|
| SCHEMBL1810139 | 0.90 | HTR2C (0.79) | HTR2CHTR1ASLC6A2SLC6A4KDM1A | |
| SCHEMBL29890520 | 0.90 | HTR2C (0.79) | HTR2CHTR1ASLC6A2SLC6A4KDM1A | |
| Fluoride SCHEMBL28219231 | 0.89 | HTR2C (0.76) | HTR2CHTR1ASLC6A2SLC6A4KDM1A | |
| SCHEMBL17303551 | 0.80 | HTR2C (0.62) | HTR2C | |
| SCHEMBL31229874 | 0.80 | HTR2C (0.62) | HTR2C | |
| SCHEMBL3644759 | 0.80 | HTR2C (0.62) | HTR2C | |
| SCHEMBL15830285 | 0.80 | HTR2C (0.62) | HTR2C | |
| SCHEMBL1513258 | 0.79 | HTR2C (1.00) | HTR2CHTR1ASLC6A2SLC6A4KDM1A | |
| Hydrochloric Acid SCHEMBL567705 | 0.79 | HTR2C (0.64) | HTR2C | |
| SCHEMBL28298504 | 0.78 | SLC18A3 (0.62) | — |
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-109715155-A | blood brain barrier-penetrating agent dopamine- β -hydroxylase inhibitors | 巴尔-波特拉及康邦亚股份有限公司 | 2019-05-03 | — | — | CN | disclosed |