Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | MGLL | Q99685 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7758552 | 1.00 | TSHR (0.44) | TSHRTHRBCYP2D6CYP2C19MGLL | |
| SCHEMBL10764193 | 0.85 | TSHR (0.38) | TSHRTHRBCYP2D6CYP2C19 | |
| SCHEMBL6909255 | 0.85 | THRB (0.35) | TSHRTHRBCYP2D6CYP2C19 | |
| SCHEMBL28797840 | 0.85 | CYP2D6 (0.33) | CYP2D6CYP2C19 | |
| SCHEMBL29996091 | 0.84 | THRB (0.40) | TSHRTHRB | |
| SCHEMBL4391883 | 0.84 | THRB (0.33) | TSHRTHRBCYP2D6CYP2C19 | |
| Ethylene Glycol SCHEMBL28189732 | 0.84 | CYP3A4 (0.37) | TSHRCYP2D6CYP2C19 | |
| SCHEMBL8971295 | 0.82 | TSHR (0.50) | TSHRCYP2D6CYP2C19 | |
| SCHEMBL15330171 | 0.82 | ALDH1A1 (0.35) | CYP2D6CYP2C19 | |
| SCHEMBL410006 | 0.81 | CYP2D6 (0.45) | TSHRTHRBCYP2D6CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0723967-B1 | Organometallic compounds and polymers made therefrom | ATOCHEM NORTH AMERICA ELF (US) | 2001-04-11 | — | — | EP | disclosed |
| US-5786392-A | SUSTAINED RELEASE; MARINE ANTIFOULING AGENT | ATOFINA CHEMICALS, INC., A CORP. OF PENNSYLVANIA | 1998-07-28 | — | — | US | disclosed |
| US-5637745-A | MARINE ANTIFOULING AGENT; SUSTAINED RELEASE | ELF ATOCHEM NORTH AMERICA, INC. (US) | 1997-06-10 | — | — | US | disclosed |
| EP-0723967-A1 | Organometallic compounds and polymers made therefrom | ELF ATOCHEM NORTH AMERICA, INC. (US) | 1996-07-31 | — | — | EP | disclosed |