Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.61 |
| ▸ | MTNR1A | P48039 | 15/20 | 0.59 |
| ▸ | MTNR1B | P49286 | 7/20 | 0.59 |
| ▸ | NQO2 | P16083 | 3/20 | 0.59 |
| ▸ | HTR2C | P28335 | 1/20 | 0.53 |
| ▸ | HTR2B | P41595 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL23256738 | 0.84 | CA1 (0.52) | MTNR1AMTNR1B | |
| SCHEMBL9490469 | 0.83 | MTNR1A (0.75) | TRPV1MTNR1AMTNR1BNQO2HTR2C | |
| SCHEMBL7017220 | 0.76 | MTNR1A (1.00) | TRPV1MTNR1AMTNR1BNQO2HTR2C | |
| SCHEMBL9424922 | 0.75 | MTNR1A (1.00) | TRPV1MTNR1AMTNR1BNQO2HTR2C | |
| SCHEMBL9493664 | 0.75 | MTNR1A (0.81) | TRPV1MTNR1AMTNR1BNQO2HTR2C | |
| SCHEMBL9491217 | 0.73 | MTNR1A (0.81) | TRPV1MTNR1AMTNR1BNQO2HTR2C | |
| SCHEMBL23257559 | 0.73 | TGM2 (0.43) | — | |
| SCHEMBL23257556 | 0.72 | TGM2 (0.50) | — | |
| SCHEMBL23256741 | 0.72 | MEN1 (0.57) | — | |
| Agomelatine SCHEMBL15822116 | 0.71 | MTNR1A (0.84) | TRPV1MTNR1AMTNR1BNQO2HTR2C |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021076755-A1 | AN ACTIVITY-GUIDE MAP OF ELECTROPHILE-CYSTEINE INTERACTIONS IN PRIMARY HUMAN IMMUNE CELLS | THE SCRIPPS RESEARCH INSTITUTE (US) | 2021-04-22 | — | — | WO | disclosed |