Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | LPAR3 | Q9UBY5 | 8/20 | 0.38 |
| ▸ | LPAR2 | Q9HBW0 | 7/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | LPAR1 | Q92633 | 5/20 | 0.36 |
| ▸ | LPAR6 | P43657 | 3/20 | 0.36 |
| ▸ | LPAR4 | Q99677 | 3/20 | 0.36 |
| ▸ | LPAR5 | Q9H1C0 | 3/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6909734 | 0.86 | CYP3A4 (0.61) | CYP3A4L3MBTL1TSHRTDP1ATM | |
| SCHEMBL284454 | 0.86 | CYP3A4 (0.66) | CYP3A4L3MBTL1TSHRTDP1ATM | |
| SCHEMBL27358148 | 0.84 | CYP3A4 (0.59) | CYP3A4L3MBTL1TSHRTDP1ATM | |
| SCHEMBL599571 | 0.82 | CYP3A4 (0.61) | CYP3A4L3MBTL1TSHRTDP1ATM | |
| SCHEMBL9497372 | 0.81 | CYP3A4 (0.59) | CYP3A4L3MBTL1TSHRTDP1ATM | |
| SCHEMBL4650272 | 0.81 | CYP3A4 (0.59) | CYP3A4L3MBTL1TSHRTDP1ATM | |
| Sulfotep SCHEMBL3451028 | 0.80 | CYP3A4 (0.55) | CYP3A4L3MBTL1TSHRTDP1ATM | |
| Sulfotep SCHEMBL4057492 | 0.80 | CYP3A4 (0.55) | CYP3A4L3MBTL1TSHRTDP1ATM | |
| SCHEMBL4446173 | 0.79 | CYP3A4 (0.58) | CYP3A4L3MBTL1TSHRTDP1ATM | |
| SCHEMBL1699004 | 0.79 | CYP3A4 (0.58) | CYP3A4L3MBTL1TSHRTDP1ATM |
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 |
|---|---|---|---|---|---|---|---|
| CN-111699224-A | Coating composition with improved corrosion resistance | PPG工业俄亥俄公司 | 2020-09-22 | — | — | CN | disclosed |