Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | IDO1 | P14902 | 4/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 5/20 | 0.40 |
| ▸ | CA2 | P00918 | 5/20 | 0.40 |
| ▸ | CA9 | Q16790 | 4/20 | 0.40 |
| ▸ | CA12 | O43570 | 3/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | GRM8 | O00222 | 1/20 | 0.37 |
| ▸ | GRM6 | O15303 | 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 | |
|---|---|---|---|---|
| SCHEMBL28039667 | 0.88 | ALDH1A1 (0.44) | ALDH1A1IDO1LOXL2CA1CA2 | |
| SCHEMBL28945418 | 0.76 | TSHR (0.46) | ALDH1A1IDO1MAPTCYP1A2TSHR | |
| SCHEMBL28039650 | 0.76 | SCN4A (0.49) | IDO1CYP1A2CYP3A4TSHRMAPK1 | |
| SCHEMBL28141975 | 0.75 | SCN4A (0.55) | — | |
| SCHEMBL942066 | 0.75 | LOXL2 (0.53) | ALDH1A1IDO1LOXL2CA1CA2 | |
| SCHEMBL18833848 | 0.75 | LOXL2 (0.53) | ALDH1A1IDO1LOXL2CA1CA2 | |
| Hydrochloric Acid SCHEMBL11740245 | 0.74 | LOXL2 (0.52) | ALDH1A1IDO1LOXL2CA1CA2 | |
| SCHEMBL894479 | 0.74 | ALDH1A1 (0.49) | ALDH1A1IDO1LOXL2CA1CA2 | |
| SCHEMBL895913 | 0.74 | ALDH1A1 (0.49) | ALDH1A1IDO1LOXL2CA1CA2 | |
| SCHEMBL6690598 | 0.74 | LOXL2 (0.52) | ALDH1A1IDO1LOXL2CA1CA2 |
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-105017312-A | Preparation method of beta-aminoethyl phosphono derivative | UNIV SOOCHOW | 2015-11-04 | — | — | CN | disclosed |