Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | TLR4 | O00206 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL12895014 | 0.93 | CA1 (0.46) | CA1CA2CA4KMT2AMAPT | |
| SCHEMBL17427855 | 0.81 | — | — | |
| SCHEMBL765417 | 0.81 | — | — | |
| SCHEMBL2690883 | 0.81 | — | — | |
| SCHEMBL15876104 | 0.79 | CYP2D6 (0.42) | CA1CA2CA4KMT2AMAPT | |
| SCHEMBL6903491 | 0.78 | MAPT (0.41) | CA1CA2CA4KMT2AMAPT | |
| SCHEMBL6901433 | 0.77 | — | — | |
| SCHEMBL919145 | 0.74 | CA1 (0.50) | CA1CA2CA4KMT2AMAPT | |
| SCHEMBL6913491 | 0.74 | CA1 (0.50) | CA1CA2CA4KMT2AMAPT | |
| SCHEMBL7064883 | 0.74 | CA1 (0.50) | CA1CA2CA4KMT2AMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20210237032-A1 | POROUS INORGANIC/ORGANIC HYBRID PARTICLES HAVING HIGH ORGANIC CONTENT AND ENHANCED PORE GEOMETRY FOR CHROMATOGRAPHIC SEPARATIONS | WATERS TECHNOLOGIES CORPORATION | 2021-08-05 | — | — | US | disclosed |
| WO-2011073843-A1 | ODORANT ALCOHOLS | FIRMENICH SA (CH) | 2011-06-23 | — | — | WO | disclosed |