Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 3/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.44 |
| ▸ | KCNN4 | O15554 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 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 |
| ▸ | KCNA3 | P22001 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 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 |
| ▸ | ABCB11 | O95342 | 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 | |
|---|---|---|---|---|
| SCHEMBL1292257 | 0.64 | CYP11B1 (0.44) | CYP11B1CYP11B2KCNN4TSHRNR1I2 | |
| SCHEMBL4800641 | 0.64 | CYP3A4 (0.39) | TSHRCYP3A4MEN1EGFRALOX15 | |
| SCHEMBL30577371 | 0.63 | CYP11B1 (0.57) | CYP11B1CYP11B2KCNN4TSHRNR1I2 | |
| SCHEMBL332630 | 0.61 | CYP11B1 (1.00) | CYP11B1CYP11B2KCNN4TSHRNR1I2 | |
| SCHEMBL9602007 | 0.61 | KCNN4 (0.38) | CYP11B1CYP11B2KCNN4TSHRNR1I2 | |
| SCHEMBL1563373 | 0.61 | HSP90AA1 (0.47) | CYP11B1CYP11B2KCNN4TSHRNR1I2 | |
| SCHEMBL2204870 | 0.60 | CYP11B1 (0.48) | CYP11B1CYP11B2KCNN4TSHRNR1I2 | |
| SCHEMBL8443367 | 0.60 | CYP11B1 (0.40) | CYP11B1CYP11B2KCNN4TSHRNR1I2 | |
| SCHEMBL8443085 | 0.60 | CYP11B1 (0.36) | CYP11B1CYP11B2KCNN4TSHRKCNA3 | |
| SCHEMBL1757361 | 0.60 | CYP11B1 (0.40) | CYP11B1CYP11B2KCNN4TSHRNR1I2 |
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 7 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 |
| EP-2079706-B1 | METHOD FOR PREPARING MEDETOMIDINE AND ITS SALTS | GRINDEKS JSC (LV) | 2011-07-20 | — | — | EP | 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 |
| US-5643878-A | TREATMENT OF RETROVIRAL DISEASES LIKE AIDS | CIBA-GEIGY CORPORATION (US) | 1997-07-01 | — | — | US | disclosed |
| EP-0618222-A2 | Dipeptid derivatives of 5-amino-4-hydroxy-hexanoic acid | CIBA-GEIGY AG (CH) | 1994-10-05 | — | — | EP | disclosed |