Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 4/20 | 0.52 |
| ▸ | CA1 | P00915 | 3/20 | 0.52 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | ACHE | P22303 | 7/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.36 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.35 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27617288 | 0.92 | CA2 (0.59) | CA2CA1ZDHHC7TSHRACHE | |
| Hydrochloric Acid SCHEMBL28717923 | 0.90 | CA2 (0.57) | CA2CA1ZDHHC7TSHRACHE | |
| SCHEMBL9569724 | 0.85 | ZDHHC7 (0.61) | CA2CA1ZDHHC7EPHX1ABCB1 | |
| SCHEMBL2166892 | 0.80 | — | — | |
| SCHEMBL28936088 | 0.76 | CA2 (0.44) | CA2CA1ZDHHC7TSHRACHE | |
| Hydrochloric Acid SCHEMBL28707493 | 0.75 | CA2 (0.42) | CA2CA1ZDHHC7TSHRACHE | |
| SCHEMBL5323280 | 0.75 | CA2 (0.42) | CA2CA1TSHRACHECYP3A4 | |
| SCHEMBL2376555 | 0.73 | FOLH1 (0.45) | CA2CA1ZDHHC7TSHR | |
| SCHEMBL5492944 | 0.73 | ZDHHC7 (0.43) | CA2CA1ZDHHC7EPHX1ABCB1 | |
| SCHEMBL10733705 | 0.72 | CA2 (0.59) | CA2CA1ZDHHC7TSHRABCB1 |
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-1721421-A | Isooctanoic acid mercapto alcohol ester based organic tin compound and its preparation method and use | UNIV SOUTH CHINA TECH (CN) | 2006-01-18 | — | — | CN | disclosed |