Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.33 |
| ▸ | POLQ | O75417 | 1/20 | 0.32 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.31 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.31 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.31 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.31 |
| ▸ | AGBL2 | Q5U5Z8 | 1/20 | 0.30 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3952679 | 0.80 | GLA (0.35) | POLQAGBL2 | |
| SCHEMBL1577283 | 0.77 | CYP11B1 (0.35) | CYP11B1CYP11B2SSTR4POLQPLA2G1B | |
| SCHEMBL17224965 | 0.77 | HTT (0.31) | — | |
| SCHEMBL2067677 | 0.77 | HTT (0.35) | CYP11B1CYP11B2SSTR4POLQPLA2G1B | |
| SCHEMBL3953710 | 0.75 | SSTR4 (0.33) | CYP11B1CYP11B2SSTR4POLQAGBL2 | |
| SCHEMBL17173721 | 0.74 | CYP11B1 (0.35) | CYP11B1CYP11B2SSTR4PLA2G1BATG4B | |
| SCHEMBL29920081 | 0.74 | CYP11B1 (0.35) | CYP11B1CYP11B2SSTR4PLA2G1BATG4B | |
| SCHEMBL21591679 | 0.71 | OPRK1 (0.35) | — | |
| SCHEMBL30994666 | 0.71 | SSTR4 (0.39) | SSTR4POLQAGBL2 | |
| SCHEMBL29333332 | 0.71 | SSTR4 (0.39) | SSTR4POLQAGBL2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1811845-A4 | SUBSTITUTED BIARYL QUINOLIN-4-YLAMINE ANALOGUES | NEUROGEN CORP (US) | 2009-07-15 | — | — | EP | disclosed |
| EP-1811845-A2 | SUBSTITUTED BIARYL QUINOLIN-4-YLAMINE ANALOGUES | NEUROGEN CORPORATION (US) | 2007-08-01 | — | — | EP | disclosed |
| WO-2006042289-A2 | SUBSTITUTED BIARYL QUINOLIN-4-YLAMINE ANALOGUES | NEUROGEN CORPORATION (US) | 2006-04-20 | — | — | WO | disclosed |