Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 9/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7875148 | 0.98 | ACHE (0.45) | ACHEHTR1ADRD2HTR2AKCNH2 | |
| SCHEMBL21065657 | 0.84 | ACHE (0.48) | ACHEHTR1ADRD2HTR2AKCNH2 | |
| SCHEMBL8781041 | 0.82 | ACHE (0.43) | ACHEHTR1ADRD2HTR2AKCNH2 | |
| SCHEMBL27827581 | 0.80 | ACHE (0.42) | ACHEHTR1ADRD2HTR2AKCNH2 | |
| SCHEMBL19978162 | 0.80 | HTR1A (0.43) | ACHEHTR1ADRD2HTR2AKCNH2 | |
| SCHEMBL7369494 | 0.78 | ACHE (0.39) | ACHEHTR1ADRD2HTR2AKCNH2 | |
| SCHEMBL1004804 | 0.75 | HTR2C (0.47) | ACHEHTR1AHTR2AKCNH2 | |
| SCHEMBL7895243 | 0.75 | HTR2C (0.47) | ACHEHTR1AHTR2AKCNH2 | |
| SCHEMBL2038159 | 0.75 | ACHE (0.45) | ACHEHTR6 | |
| SCHEMBL30918006 | 0.75 | ACHE (0.45) | ACHEHTR6 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-RE37438-E1 | Acetamidine derivatives and their use as inhibitors for the nitric oxide synthase | GLAXO WELLCOME INC. | 2001-11-06 | — | — | US | disclosed |
| US-5866612-A | Acetamidine derivatives and their use as inhibitors for the nitric oxide synthase | GLAXO WELLCOME INC. (US) | 1999-02-02 | — | — | US | disclosed |
| EP-0799191-A1 | ACETAMIDINE DERIVATIVES AND THEIR USE AS INHIBITORS FOR THE NITRIC OXIDE SYNTHASE | THE WELLCOME FOUNDATION LIMITED (GB) | 1997-10-08 | — | — | EP | disclosed |
| WO-1996019440-A1 | ACETAMIDINE DERIVATIVES AND THEIR USE AS INHIBITORS FOR THE NITRIC OXIDE SYNTHASE | THE WELLCOME FOUNDATION LIMITED (GB) | 1996-06-27 | — | — | WO | disclosed |