Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.59 |
| ▸ | NQO2 | P16083 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.54 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 2/20 | 0.49 |
| ▸ | CA2 | P00918 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.49 |
| ▸ | ESR1 | P03372 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL9241494 | 1.00 | MAPT (0.59) | MAPTNQO2MEN1KMT2ACYP1A2 | |
| SCHEMBL11526325 | 0.85 | MAPT (0.59) | MAPTMEN1KMT2ACYP1A2CYP3A4 | |
| SCHEMBL11526320 | 0.85 | MAPT (0.59) | MAPTMEN1KMT2ACYP1A2CYP3A4 | |
| SCHEMBL9799775 | 0.85 | TDP1 (0.52) | MAPTKMT2ACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL9246164 | 0.85 | TDP1 (0.52) | MAPTKMT2ACYP1A2CYP3A4CYP2C19 | |
| 4-Methoxybenzoic Acid Ethyl Ester SCHEMBL203475 | 0.84 | CA1 (0.66) | MAPTMEN1KMT2ACYP1A2CYP3A4 | |
| 4-Methoxybenzoic Acid Ethyl Ester SCHEMBL27605414 | 0.83 | CA1 (0.63) | MAPTMEN1KMT2ACYP1A2CYP3A4 | |
| SCHEMBL9245384 | 0.83 | HPGD (0.45) | MAPTMEN1KMT2ACYP1A2CYP3A4 | |
| SCHEMBL9240945 | 0.83 | HPGD (0.45) | MAPTMEN1KMT2ACYP1A2CYP3A4 | |
| SCHEMBL9799811 | 0.83 | HPGD (0.45) | MAPTMEN1KMT2ACYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5068252-A | Acids, esters, amides, alcohol and ether derivatives | ALLERGAN, INC. (US) | 1991-11-26 | — | — | US | disclosed |