Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 3/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.41 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | XDH | P47989 | 3/20 | 0.38 |
| ▸ | SLC22A12 | Q96S37 | 3/20 | 0.38 |
| ▸ | SYK | P43405 | 2/20 | 0.36 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.35 |
| ▸ | ACLY | P53396 | 1/20 | 0.35 |
| ▸ | ABL1 | P00519 | 1/20 | 0.34 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | LDHA | P00338 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL16571121 | 0.90 | XDH (0.39) | ALOX15XDHSLC22A12NUDT1CYP2C8 | |
| SCHEMBL16570969 | 0.88 | LRRK2 (0.40) | ALOX15XDHSLC22A12SYKNUDT1 | |
| SCHEMBL16571686 | 0.87 | XDH (0.39) | XDHSLC22A12CYP2C8CYP2C9FFAR1 | |
| SCHEMBL16570967 | 0.85 | ALOX15 (0.35) | ALOX15XDHSLC22A12SYKNUDT1 | |
| SCHEMBL16571420 | 0.85 | ALOX15 (0.49) | ALOX15XDHSLC22A12SYKNUDT1 | |
| SCHEMBL16571417 | 0.85 | XDH (0.38) | ALOX15XDHSLC22A12CYP2C8CYP2C9 | |
| SCHEMBL16571385 | 0.83 | ALOX15 (0.47) | ALOX15NUDT1 | |
| SCHEMBL19478398 | 0.82 | XDH (0.39) | ALOX15XDHSLC22A12SYK | |
| SCHEMBL16571392 | 0.81 | PTPN11 (0.42) | ALOX15XDHSLC22A12SYKNUDT1 | |
| SCHEMBL16571148 | 0.81 | NUDT1 (0.43) | ALOX15XDHSLC22A12SYKNUDT1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3044207-A1 | INDOL-CARBOXAMIDE DERIVATIVES | F. Hoffmann-La Roche AG (CH) | 2016-07-20 | — | — | EP | disclosed |
| WO-2015036412-A1 | INDOL-CARBOXAMIDE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2015-03-19 | — | — | WO | disclosed |