Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.56 |
| ▸ | CTSD | P07339 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.48 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.48 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.48 |
| ▸ | GMNN | O75496 | 1/20 | 0.48 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.48 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.48 |
| ▸ | GSR | P00390 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL195311 | 0.90 | ALDH1A1 (0.62) | ALDH1A1CTSDSMN1; SMN2MAPK1HPGD | |
| Hydrochloric Acid SCHEMBL30013910 | 0.88 | ALDH1A1 (0.61) | ALDH1A1CTSDSMN1; SMN2MAPK1HPGD | |
| Fluoride SCHEMBL27635664 | 0.88 | ALDH1A1 (0.61) | ALDH1A1CTSDSMN1; SMN2MAPK1HPGD | |
| SCHEMBL28230887 | 0.86 | ALDH1A1 (0.54) | ALDH1A1CTSDSMN1; SMN2MAPK1HPGD | |
| SCHEMBL18641424 | 0.86 | VCAM1 (0.54) | ALDH1A1SMN1; SMN2MAPK1HPGDHTT | |
| SCHEMBL975117 | 0.84 | ALDH1A1 (0.68) | ALDH1A1CTSDSMN1; SMN2HTTMAPT | |
| SCHEMBL10718895 | 0.82 | ALDH1A1 (0.57) | ALDH1A1CTSDSMN1; SMN2MAPK1HPGD | |
| SCHEMBL16635224 | 0.81 | AKR1C4 (0.53) | ALDH1A1CTSDSMN1; SMN2HTTMAPT | |
| SCHEMBL1898380 | 0.81 | SMN1; SMN2 (0.57) | ALDH1A1CTSDSMN1; SMN2MAPK1HPGD | |
| SCHEMBL13982727 | 0.81 | MAPT (0.60) | ALDH1A1CTSDSMN1; SMN2MAPK1HPGD |
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-108347943-A | HEPATITIS B CORE PROTEIN MODULATORS | 组装生物科学股份有限公司 | 2018-07-31 | — | — | CN | disclosed |