Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGM2 | P21980 | 1/20 | 0.50 |
| ▸ | BCHE | P06276 | 1/20 | 0.46 |
| ▸ | P2RX1 | P51575 | 2/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 5/20 | 0.43 |
| ▸ | RHOC | P08134 | 4/20 | 0.43 |
| ▸ | RHOA | P61586 | 4/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CCR2 | P41597 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | TACR1 | P25103 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL22446313 | 0.83 | RHOC (0.47) | TGM2BCHEP2RX1TRPA1RHOC | |
| SCHEMBL23257554 | 0.82 | TGM2 (0.45) | TGM2BCHEP2RX1RHOCRHOA | |
| SCHEMBL22446314 | 0.80 | RHOC (0.45) | TGM2BCHEP2RX1TRPA1RHOC | |
| SCHEMBL13752959 | 0.80 | TACR1 (0.56) | RHOCRHOAALDH1A1POLBTACR1 | |
| SCHEMBL18763049 | 0.80 | TGM2 (0.69) | TGM2P2RX1ALDH1A1MAPTTACR1 | |
| SCHEMBL20857042 | 0.80 | P2RX1 (0.62) | TGM2P2RX1TRPA1RHOCRHOA | |
| SCHEMBL18763027 | 0.79 | RHOC (0.44) | TGM2BCHEP2RX1RHOCRHOA | |
| SCHEMBL23256742 | 0.79 | RHOC (0.47) | TGM2BCHEP2RX1TRPA1RHOC | |
| SCHEMBL23257559 | 0.77 | TGM2 (0.43) | TGM2BCHEP2RX1RHOCRHOA | |
| SCHEMBL18778619 | 0.76 | TGM2 (0.59) | TGM2P2RX1ALDH1A1MAPT |
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 |