Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MASP2 | O00187 | 1/20 | 0.40 |
| ▸ | PLAU | P00749 | 1/20 | 0.40 |
| ▸ | THPO | P40225 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 8/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 7/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.39 |
| ▸ | APEX1 | P27695 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | F2 | P00734 | 1/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.39 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28826006 | 0.85 | ALDH1A1 (0.46) | MAPTTDP1ALDH1A1CYP3A4KDM4E | |
| SCHEMBL7361311 | 0.83 | NPSR1 (0.43) | PLAUMAPTTDP1ALDH1A1CYP3A4 | |
| SCHEMBL7079951 | 0.82 | ALDH1A1 (0.39) | ALDH1A1CYP2C19RAB9ATSHRMEN1 | |
| SCHEMBL11297057 | 0.71 | CYP3A4 (0.41) | MASP2PLAUTHPOMAPTTDP1 | |
| SCHEMBL3073692 | 0.71 | ALDH1A1 (0.45) | PLAUMAPTTDP1ALDH1A1CYP3A4 | |
| SCHEMBL26108874 | 0.70 | CYP3A4 (0.48) | MAPTTDP1ALDH1A1CYP3A4KDM4E | |
| SCHEMBL4667393 | 0.70 | ALDH1A1 (0.44) | MAPTTDP1ALDH1A1CYP3A4KDM4E | |
| Hydrochloric Acid SCHEMBL28482173 | 0.69 | ALDH1A1 (0.43) | PLAUMAPTTDP1ALDH1A1CYP3A4 | |
| SCHEMBL10735461 | 0.69 | LMNA (0.41) | THPOMAPTALDH1A1CYP3A4KDM4E | |
| SCHEMBL458998 | 0.69 | ALDH1A1 (0.46) | PLAUMAPTTDP1ALDH1A1CYP3A4 |
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-104910047-A | Preparation method of dabigatran etexilate intermediate | CHANGZHOU SUNLIGHT PHARM CO LTD | 2015-09-16 | — | — | CN | disclosed |