Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGFBR1 | P36897 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | GNPAT | O15228 | 1/20 | 0.36 |
| ▸ | FNTA | P49354 | 2/20 | 0.34 |
| ▸ | FNTB | P49356 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | THPO | P40225 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | MME | P08473 | 3/20 | 0.33 |
| ▸ | GRN | P28799 | 1/20 | 0.33 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL7744038 | 0.88 | CA2 (0.40) | CA2CA4GNPATFNTAFNTB | |
| SCHEMBL472192 | 0.86 | CA2 (0.44) | CA2CA4GNPATMAPTSMN1; SMN2 | |
| SCHEMBL20521 | 0.86 | CA2 (0.44) | CA2CA4GNPATMAPTSMN1; SMN2 | |
| SCHEMBL28623751 | 0.84 | CA2 (0.42) | CA2CA4GNPATMAPTSMN1; SMN2 | |
| Phosphine SCHEMBL27579074 | 0.84 | CA2 (0.42) | CA2CA4GNPATMAPTSMN1; SMN2 | |
| SCHEMBL10801445 | 0.84 | CA2 (0.42) | CA2CA4GNPATMAPTSMN1; SMN2 | |
| SCHEMBL28372032 | 0.84 | CA2 (0.42) | CA2CA4GNPATMAPTSMN1; SMN2 | |
| SCHEMBL28623754 | 0.84 | CA2 (0.42) | CA2CA4GNPATMAPTSMN1; SMN2 | |
| SCHEMBL10801439 | 0.84 | CA2 (0.42) | CA2CA4GNPATMAPTSMN1; SMN2 | |
| SCHEMBL18794824 | 0.79 | CA2 (0.39) | CA2CA4GNPATMAPTSMN1; SMN2 |
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-111569849-A | Immobilized metal chelate chromatography medium and preparation method and application thereof | 北京石油化工学院 | 2020-08-25 | — | — | CN | disclosed |