Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 4/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | ACE | P12821 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL28022770 | 0.95 | TSHR (0.37) | CYP3A4TSHRATMTDP1CA2 | |
| SCHEMBL28022788 | 0.95 | TSHR (0.37) | CYP3A4TSHRATMTDP1CA2 | |
| SCHEMBL28184378 | 0.84 | TSHR (0.35) | CYP3A4TSHRATMTDP1CA2 | |
| SCHEMBL28022744 | 0.83 | CA2 (0.45) | CYP3A4TSHRATMTDP1CA2 | |
| SCHEMBL28183588 | 0.82 | LMNA (0.51) | CYP3A4TSHRATMTDP1MAPK1 | |
| SCHEMBL6003876 | 0.80 | GPR84 (0.50) | CA2RECQLMEN1KMT2A | |
| SCHEMBL10342900 | 0.80 | GPR84 (0.50) | CA2RECQLMEN1KMT2A | |
| SCHEMBL28183601 | 0.80 | BLM (0.40) | — | |
| SCHEMBL9219209 | 0.80 | GPR84 (0.50) | CA2RECQLMEN1KMT2A | |
| SCHEMBL28022791 | 0.80 | GPR84 (0.50) | CA2RECQLMEN1KMT2A |
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-104755510-B | Ziegler natta catalyst system of internal donor and preparation method thereof is used as comprising 1,2 phenylene diester | 印度石油有限公司 | 2017-11-07 | — | — | CN | disclosed |