Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 4/20 | 0.43 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.36 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.36 |
| ▸ | CCKBR | P32239 | 2/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.36 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.36 |
| ▸ | GMNN | O75496 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | TRPM2 | O94759 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27456864 | 0.79 | CYP11B1 (0.40) | CYP11B1CYP11B2CYP19A1MAPK1NR1I2 | |
| SCHEMBL16828671 | 0.79 | CYP11B1 (0.40) | CYP11B1CYP11B2CYP19A1KCNH2RAB9A | |
| SCHEMBL16371592 | 0.77 | CYP11B1 (0.47) | CYP11B1CYP11B2CYP19A1MAPK1NR1I2 | |
| SCHEMBL4806085 | 0.77 | CYP11B1 (0.43) | CYP11B1CYP11B2CYP19A1MAPK1NR1I2 | |
| SCHEMBL21721462 | 0.74 | TDP1 (0.32) | TDP1 | |
| SCHEMBL6071929 | 0.73 | CYP11B1 (0.35) | CYP11B1CYP11B2 | |
| SCHEMBL6071924 | 0.73 | CYP11B1 (0.35) | CYP11B1CYP11B2 | |
| SCHEMBL2204500 | 0.73 | CYP11B1 (0.43) | CYP11B1CYP11B2CYP19A1MAPK1NR1I2 | |
| SCHEMBL11891091 | 0.71 | CYP11B1 (0.39) | CYP11B1CYP11B2CYP19A1MAPK1NR1I2 | |
| SCHEMBL20225762 | 0.70 | FYN (0.32) | CYP11B1CYP11B2FYN |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101711242-B | ((bicyclic heteroaryl) imidazolyl) methyl heteroaryl compounds as adrenergic receptor agonists | ALLERGAN INC | 2013-09-25 | — | — | CN | disclosed |
| CN-101743240-B | ((phenyl) imidazolyl) methyl heteroaryl compounds | ALLERGAN INC | 2013-07-17 | — | — | CN | disclosed |
| CN-101743240-A | ((phenyl) imidazolyl) methyl heteroaryl compounds | ALLERGAN INC | 2010-06-16 | — | — | CN | disclosed |
| CN-101711242-A | ((bicyclic heteroaryl) imidazolyl) methyl heteroaryl compounds as adrenergic receptor agonists | ALLERGAN INC | 2010-05-19 | — | — | CN | disclosed |
| CN-1856475-A | Isoquinoline potassium channel inhibitors | MERCK & CO INC (US) | 2006-11-01 | — | — | CN | disclosed |