Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 3/20 | 0.45 |
| ▸ | HTR2C | P28335 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.45 |
| ▸ | HTR1D | P28221 | 2/20 | 0.45 |
| ▸ | HTR1B | P28222 | 2/20 | 0.45 |
| ▸ | HTR7 | P34969 | 2/20 | 0.45 |
| ▸ | HTR6 | P50406 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | MPO | P05164 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | CTSK | P43235 | 1/20 | 0.45 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
| ▸ | MC1R | Q01726 | 1/20 | 0.44 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.44 |
| ▸ | SSTR2 | P30874 | 1/20 | 0.43 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28981236 | 0.85 | MAPT (0.45) | CYP3A4CYP2D6CYP1A2SLC6A4ATM | |
| SCHEMBL9281323 | 0.83 | HTR2A (0.42) | HTR2AHTR2CCYP3A4HTR1DHTR1B | |
| SCHEMBL273916 | 0.82 | HTR2A (0.47) | HTR2AHTR2CCYP3A4HTR1DHTR1B | |
| SCHEMBL29611302 | 0.82 | HTR2A (0.47) | HTR2AHTR2CCYP3A4HTR1DHTR1B | |
| SCHEMBL30969153 | 0.81 | GPR84 (0.46) | HTR2ACYP3A4HTR6CYP2D6SLC6A4 | |
| SCHEMBL18923935 | 0.81 | GPR84 (0.46) | HTR2ACYP3A4HTR6CYP2D6SLC6A4 | |
| Hydrochloric Acid SCHEMBL4526379 | 0.81 | PMP22 (0.49) | HTR2AHTR2CCYP3A4HTR1DHTR1B | |
| Hydrochloric Acid SCHEMBL30098563 | 0.81 | PMP22 (0.49) | HTR2AHTR2CCYP3A4HTR1DHTR1B | |
| SCHEMBL13611510 | 0.77 | GPR84 (0.47) | HTR2AHTR2CCYP3A4HTR1DHTR1B | |
| SCHEMBL20747968 | 0.77 | ATM (0.41) | HTR2AHTR2CCYP3A4HTR1DHTR1B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0722436-A4 | MERCAPTOSULFIDE METALLOPROTEINASE INHIBITORS | UNIV FLORIDA STATE (US) | 1996-11-20 | — | — | EP | disclosed |
| EP-0722436-A1 | MERCAPTOSULFIDE METALLOPROTEINASE INHIBITORS | FLORIDA STATE UNIVERSITY (US) | 1996-07-24 | — | — | EP | disclosed |
| WO-1995009833-A1 | MERCAPTOSULFIDE METALLOPROTEINASE INHIBITORS | FLORIDA STATE UNIVERSITY (US) | 1995-04-13 | — | — | WO | disclosed |