Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFD | P00746 | 2/20 | 0.61 |
| ▸ | MGLL | Q99685 | 4/20 | 0.57 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.53 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.53 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.51 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.51 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.51 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.51 |
| ▸ | CNR1 | P21554 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL28047630 | 0.87 | CFD (0.57) | CFDMGLLHDAC1TAAR1CYP17A1 | |
| SCHEMBL7511547 | 0.84 | MGLL (0.78) | MGLLHDAC1CNR1POLBHDAC6 | |
| SCHEMBL30331540 | 0.84 | MGLL (0.78) | MGLLHDAC1CNR1POLBHDAC6 | |
| SCHEMBL3003205 | 0.83 | CFD (0.59) | CFDENPP2 | |
| SCHEMBL27965263 | 0.82 | CFD (0.52) | CFDMGLLHDAC1TAAR1CYP17A1 | |
| SCHEMBL2569063 | 0.81 | MGLL (0.85) | CFDMGLLENPP2 | |
| SCHEMBL1684366 | 0.79 | CYP17A1 (0.60) | CFDMGLLHDAC1CYP17A1CYP11B1 | |
| SCHEMBL111906 | 0.79 | PLG (0.53) | HDAC6 | |
| SCHEMBL6185300 | 0.77 | MGLL (0.57) | MGLLHDAC1CYP17A1CYP11B1CYP11B2 | |
| SCHEMBL29265483 | 0.77 | MGLL (0.66) | MGLLCNR1POLBMEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103214450-A | Modulators of atp-binding cassette transporters | VERTEX PHARMA | 2013-07-24 | — | — | CN | disclosed |
| CN-101395147-B | 1- (benzo [ D ] [1,3] dioxol-5-yl) -N- (phenyl) cyclopropane-carboxamide derivatives and related compounds as modulators of ATP-binding cassette transporters for the treatment of cystic fibrosis | VERTEX PHARMA | 2013-05-29 | — | — | CN | disclosed |
| CN-101395147-A | 1- (benzo [ D ] [1,3] dioxol-5-yl) -N- (phenyl) cyclopropane-carboxamide derivatives and related compounds as modulators of ATP-binding cassette transporters for the treatment of cystic fibrosis | VERTEX PHARMA (US) | 2009-03-25 | — | — | CN | disclosed |