Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | TNFRSF1A | P19438 | 2/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | DHFR | P00374 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.32 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL31357894 | 0.83 | PTGS2 (0.44) | PTGS2ALDH1A1TSHRTDP1TNFRSF1A | |
| SCHEMBL6668536 | 0.76 | PTGS2 (0.46) | PTGS2ALDH1A1TSHRTDP1TNFRSF1A | |
| SCHEMBL5857102 | 0.73 | ALDH1A1 (0.52) | PTGS2ALDH1A1TSHRTDP1TNFRSF1A | |
| SCHEMBL22360314 | 0.73 | CA1 (0.64) | PTGS2ALDH1A1TSHRTDP1TNFRSF1A | |
| SCHEMBL2947022 | 0.73 | PTGS2 (0.47) | PTGS2ALDH1A1TSHRTDP1TNFRSF1A | |
| SCHEMBL1304840 | 0.72 | PTGS2 (0.43) | PTGS2ALDH1A1TSHRTDP1TNFRSF1A | |
| SCHEMBL6062560 | 0.71 | PTGS2 (0.46) | PTGS2ALDH1A1TSHRTDP1TNFRSF1A | |
| SCHEMBL3157771 | 0.71 | TDP1 (0.52) | PTGS2ALDH1A1TSHRTDP1TNFRSF1A | |
| SCHEMBL11743999 | 0.71 | PTGS2 (0.46) | PTGS2ALDH1A1TSHRTDP1TNFRSF1A | |
| SCHEMBL15063256 | 0.71 | PTGS2 (0.46) | PTGS2ALDH1A1TSHRTDP1TNFRSF1A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106995461-B | A kind of Phosphine ligands of the structure containing benzofuran and its preparation method and application | 中山大学 | 2019-11-08 | — | — | CN | disclosed |
| CN-106995461-A | A kind of Phosphine ligands of the structure containing benzofuran and its preparation method and application | 中山大学 | 2017-08-01 | — | — | CN | disclosed |
| CN-103189383-B | Biaryl diphosphine ligand, its intermediate and the purposes in asymmetry catalysis thereof | KANATA CHEMICAL TECHNOLOGIES INC. (CA) | 2016-11-30 | — | — | CN | disclosed |
| EP-0850945-B1 | Chiral diphosphine compound, intermediate for preparing the same, transition metal complex having the same diphosphine compound as ligand and asymmetric hydrogenation catalyst | TAKASAGO PERFUMERY CO LTD (JP) | 2002-11-27 | — | — | EP | disclosed |
| EP-0850945-A1 | Chiral diphosphine compound, intermediate for preparing the same, transition metal complex having the same diphosphine compound as ligand and asymmetric hydrogenation catalyst | Takasago International Corporation (JP) | 1998-07-01 | — | — | EP | disclosed |