Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.54 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.36 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.35 |
| ▸ | GRM5 | P41594 | 2/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3721720 | 0.89 | GPBAR1 (0.54) | GPBAR1KCNA3CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL3716494 | 0.84 | GPBAR1 (0.57) | GPBAR1KCNA3CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL3713000 | 0.77 | GPBAR1 (0.45) | GPBAR1KCNA3CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL3723393 | 0.72 | GPBAR1 (0.46) | GPBAR1KCNA3CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL3793533 | 0.71 | GPBAR1 (0.88) | GPBAR1KCNA3RAB9ANR2F2SCN9A | |
| SCHEMBL13152511 | 0.70 | GPBAR1 (0.43) | GPBAR1KCNA3CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL3713382 | 0.68 | GPBAR1 (0.70) | GPBAR1KCNA3RAB9ANR2F2SCN9A | |
| SCHEMBL3715588 | 0.67 | GPBAR1 (0.46) | GPBAR1KCNA3RAB9ANR2F2SCN9A | |
| SCHEMBL31364101 | 0.67 | KCNA3 (0.65) | GPBAR1KCNA3CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL5445170 | 0.67 | KCNA3 (0.65) | GPBAR1KCNA3CYP19A1CYP11B1CYP11B2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010117090-A1 | NOVEL ISOQUINOLINYLOXYMETHYL HETEROARYL DERIVATIVES | BANYU PHARMACEUTICAL CO.,LTD. (JP) | 2010-10-14 | — | — | WO | claimed |
| WO-2010117090-A1 | NOVEL ISOQUINOLINYLOXYMETHYL HETEROARYL DERIVATIVES | BANYU PHARMACEUTICAL CO.,LTD. (JP) | 2010-10-14 | — | — | WO | disclosed |
| WO-2010117090-A1 | NOVEL ISOQUINOLINYLOXYMETHYL HETEROARYL DERIVATIVES | BANYU PHARMACEUTICAL CO.,LTD. (JP) | 2010-10-14 | — | — | WO | disclosed |