Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | CTSG | P08311 | 2/20 | 0.32 |
| ▸ | KLK7 | P49862 | 2/20 | 0.32 |
| ▸ | KLK14 | Q9P0G3 | 2/20 | 0.32 |
| ▸ | KLK5 | Q9Y337 | 2/20 | 0.32 |
| ▸ | CTRC | Q99895 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL648702 | 0.82 | BCAT2 (0.40) | PTGS2ADRA1ACYP2C9ADRA2AADRA2C | |
| SCHEMBL9641951 | 0.81 | ALDH1A1 (0.35) | PTGS2ADRA1AADRA2AADRA2CADRA1D | |
| Barbituric Acid SCHEMBL9641626 | 0.75 | TDP2 (0.38) | PTGS2ADRA1ACYP3A4TSHRCYP2C19 | |
| SCHEMBL9641657 | 0.73 | ADRA1A (0.32) | PTGS2ADRA1AADRA2AADRA2CADRA1D | |
| SCHEMBL9641604 | 0.71 | GAA (0.37) | ADRA1ACYP3A4TSHRCYP2C19ADRA2A | |
| Iodobenzene SCHEMBL28180671 | 0.70 | CYP2A6 (0.41) | CYP2C9CYP2A6CYP1A2 | |
| SCHEMBL9641551 | 0.70 | ADRA1A (0.35) | ADRA1ACYP3A4TSHRCYP2C19ADRA2A | |
| SCHEMBL9641624 | 0.69 | PDE3B (0.40) | BRD4 | |
| SCHEMBL9641995 | 0.69 | DRD2 (0.35) | ADRA1ATSHRADRA2AADRA2CADRA1D | |
| SCHEMBL8106699 | 0.66 | LOX (0.47) | PTGS2ADRA1ACYP2C9HSD11B1LMNA |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0225478-B1 | IODONIUM YLIDE ANTIMICROBIAL COMPOUNDS | THE DOW CHEMICAL COMPANY (US) | 1990-05-16 | — | — | EP | claimed |
| EP-0225478-A1 | Iodonium ylide antimicrobial compounds | THE DOW CHEMICAL COMPANY (US) | 1987-06-16 | — | — | EP | claimed |
| US-5106407-A | Algicides, funcilides, bactericides | THE DOW CHEMICAL COMPANY (US) | 1992-04-21 | — | — | US | disclosed |
| EP-0225478-B1 | IODONIUM YLIDE ANTIMICROBIAL COMPOUNDS | THE DOW CHEMICAL COMPANY (US) | 1990-05-16 | — | — | EP | disclosed |
| EP-0225478-A1 | Iodonium ylide antimicrobial compounds | THE DOW CHEMICAL COMPANY (US) | 1987-06-16 | — | — | EP | disclosed |