Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.85 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.85 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.46 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.46 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | SMPD1 | P17405 | 3/20 | 0.43 |
| ▸ | FDPS | P14324 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LAP3 | P28838 | 1/20 | 0.40 |
| ▸ | SGPL1 | O95470 | 4/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL31438893 | 1.00 | CYP3A4 (0.85) | CYP3A4L3MBTL1PRSS1PRSS2PRSS3 | |
| SCHEMBL20987291 | 0.96 | CYP3A4 (0.92) | CYP3A4L3MBTL1PRSS1PRSS2PRSS3 | |
| SCHEMBL10901321 | 0.92 | CYP3A4 (0.71) | CYP3A4L3MBTL1TSHRSMPD1FDPS | |
| SCHEMBL8564175 | 0.92 | CYP3A4 (0.71) | CYP3A4L3MBTL1TSHRSMPD1FDPS | |
| SCHEMBL19362857 | 0.92 | CYP3A4 (1.00) | CYP3A4L3MBTL1TSHRATMTDP1 | |
| SCHEMBL35485 | 0.92 | CYP3A4 (1.00) | CYP3A4L3MBTL1TSHRATMTDP1 | |
| SCHEMBL7942552 | 0.92 | CYP3A4 (0.71) | CYP3A4L3MBTL1TSHRSMPD1FDPS | |
| SCHEMBL10902137 | 0.92 | CYP3A4 (0.71) | CYP3A4L3MBTL1TSHRSMPD1FDPS | |
| SCHEMBL1986718 | 0.90 | CYP3A4 (0.75) | CYP3A4L3MBTL1TSHRSMPD1FDPS | |
| SCHEMBL29880197 | 0.90 | CYP3A4 (0.96) | CYP3A4L3MBTL1TSHRATMTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5922654-A | TWO OR MORE ORGANOMETALLIC COMPOUNDS WHERE THE METAL IS A TRANSITION METAL OR SEMIMETAL, OR ZINC; FOR EXAMPLE, ZINC DIALKYLDITHIOPHOSPHATE, OR NICKEL DIALKYLDITHIOCARBAMATE; HIGHER LOAD BEARING PROPERTIES, HIGH TEMPERATURE PERFORMANCE | NSK LTD. (JP) | 1999-07-13 | — | — | US | disclosed |