Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.44 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.43 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.43 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.43 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.43 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.42 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.42 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.42 |
| ▸ | GMNN | O75496 | 1/20 | 0.42 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1984350 | 0.84 | ALDH1A1 (0.50) | ALDH1A1TDP1KMT2AMEN1MAPT | |
| SCHEMBL29192912 | 0.80 | HTT (0.44) | HTTALDH1A1TDP1KMT2ALMNA | |
| SCHEMBL29766208 | 0.79 | HTT (0.54) | HTTALDH1A1TDP1KMT2ALMNA | |
| SCHEMBL28808729 | 0.79 | HTT (0.54) | HTTALDH1A1TDP1KMT2ALMNA | |
| SCHEMBL28863790 | 0.77 | HTT (0.49) | HTTALDH1A1TDP1KMT2ALMNA | |
| SCHEMBL29944963 | 0.77 | HTT (0.49) | HTTALDH1A1TDP1KMT2ALMNA | |
| SCHEMBL15727851 | 0.77 | SMN1; SMN2 (0.41) | HTTALDH1A1TDP1KMT2ALMNA | |
| SCHEMBL13228930 | 0.77 | HTT (0.62) | HTTALDH1A1TDP1KMT2ALMNA | |
| SCHEMBL2484847 | 0.75 | VCAM1 (0.57) | ALDH1A1TDP1KMT2ALMNAHPGD | |
| SCHEMBL6340501 | 0.75 | MEN1 (0.54) | HTTALDH1A1KMT2AMEN1PRKCZ |
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-102227436-A | Macrocyclic compounds as hepatitis c virus inhibitors | BRISTOL MYERS SQUIBB CO | 2011-10-26 | — | — | CN | disclosed |