Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APEX1 | P27695 | 1/20 | 0.64 |
| ▸ | NR1H4 | Q96RI1 | 6/20 | 0.61 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | METAP2 | P50579 | 1/20 | 0.51 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.51 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL8776773 | 0.89 | KMT2A (0.69) | APEX1KMT2ACYP1A2CYP2C19HPGD | |
| SCHEMBL12700348 | 0.86 | APEX1 (0.87) | APEX1NR1H4EPHX2KMT2ACYP1A2 | |
| SCHEMBL10649706 | 0.83 | ALDH1A1 (0.62) | APEX1KMT2ACYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL20022683 | 0.83 | HPGD (0.68) | APEX1KMT2ASMN1; SMN2HPGDALDH1A1 | |
| SCHEMBL20022705 | 0.83 | APEX1 (0.57) | APEX1KMT2ACYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL1060622 | 0.82 | HPGD (0.71) | APEX1NR1H4EPHX2KMT2ACYP1A2 | |
| SCHEMBL29285015 | 0.82 | APEX1 (0.64) | APEX1NR1H4EPHX2KMT2ACYP1A2 | |
| SCHEMBL16088749 | 0.82 | APEX1 (0.69) | APEX1NR1H4EPHX2KMT2ACYP1A2 | |
| SCHEMBL27752218 | 0.82 | KMT2A (0.64) | APEX1NR1H4EPHX2KMT2ACYP1A2 | |
| SCHEMBL10099575 | 0.80 | NR1H4 (0.84) | NR1H4EPHX2KMT2AHPGDPOLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008003800-A1 | DERIVATIVES OF BENZO[D]ISOTHIAZOLES AS HISTONE DEACETYLASE INHIBITORS | UNIVERSIDAD DE GRANADA (ES) | 2008-01-10 | — | — | WO | disclosed |