Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 7/20 | 0.57 |
| ▸ | CYP11B2 | P19099 | 7/20 | 0.57 |
| ▸ | NPC1 | O15118 | 3/20 | 0.54 |
| ▸ | RAB9A | P51151 | 3/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.54 |
| ▸ | STAT1 | P42224 | 1/20 | 0.54 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.54 |
| ▸ | RELA | Q04206 | 1/20 | 0.54 |
| ▸ | WNT3A | P56704 | 4/20 | 0.53 |
| ▸ | LDHA | P00338 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | HPGDS | O60760 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL538575 | 0.86 | ABCC4 (0.58) | CYP11B1CYP11B2NPC1RAB9AWNT3A | |
| SCHEMBL5144169 | 0.85 | CYP11B1 (0.50) | CYP11B1CYP11B2NPC1RAB9AWNT3A | |
| SCHEMBL28103317 | 0.85 | RAB9A (0.52) | CYP11B1CYP11B2NPC1RAB9AHPGD | |
| SCHEMBL1720975 | 0.77 | CYP11B1 (0.59) | CYP11B1CYP11B2NPC1RAB9ALDHA | |
| SCHEMBL2412899 | 0.77 | CYP11B1 (0.59) | CYP11B1CYP11B2NPC1RAB9ALDHA | |
| SCHEMBL30083539 | 0.77 | CYP11B1 (0.59) | CYP11B1CYP11B2NPC1RAB9ALDHA | |
| SCHEMBL5298125 | 0.77 | FFAR1 (0.61) | CYP11B1CYP11B2NPC1RAB9ANFKB1 | |
| SCHEMBL1177086 | 0.77 | CA2 (0.48) | WNT3ASMN1; SMN2 | |
| SCHEMBL25356476 | 0.76 | TPH1 (0.60) | CYP11B1CYP11B2LDHA | |
| SCHEMBL25356472 | 0.76 | TPH1 (0.60) | CYP11B1CYP11B2LDHA |
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 |
|---|---|---|---|---|---|---|---|
| EP-2250162-B1 | AMIDE DERIVATIVES AS POSITIVE ALLOSTERIC MODULATORS AND METHODS OF USE THEREOF | ABBVIE INC (US) | 2014-03-19 | — | — | EP | disclosed |