Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | XDH | P47989 | 3/20 | 0.38 |
| ▸ | SLC22A12 | Q96S37 | 3/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | GCGR | P47871 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | SYK | P43405 | 2/20 | 0.35 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.35 |
| ▸ | ABL1 | P00519 | 2/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 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 | 0.91 | XDH (0.39) | XDHSLC22A12ALOX15CYP2C8CYP2C9 | |
| SCHEMBL16571406 | 0.88 | PDE4A (0.41) | XDHSLC22A12ALOX15CYP2C8CYP2C9 | |
| SCHEMBL16571044 | 0.88 | MPL (0.39) | LRRK2NPC1RAB9AMAPTTHRB | |
| SCHEMBL16571417 | 0.86 | XDH (0.38) | NPC1RAB9AXDHSLC22A12ALOX15 | |
| SCHEMBL19478398 | 0.85 | XDH (0.39) | NPC1RAB9AMAPTMAPK1XDH | |
| SCHEMBL16570967 | 0.84 | ALOX15 (0.35) | NPC1RAB9AXDHSLC22A12ALOX15 | |
| SCHEMBL16571420 | 0.84 | ALOX15 (0.49) | NPC1RAB9AMAPTXDHSLC22A12 | |
| SCHEMBL16571392 | 0.82 | PTPN11 (0.42) | XDHSLC22A12ALOX15SYKNUDT1 | |
| SCHEMBL16571385 | 0.82 | ALOX15 (0.47) | ALOX15MEN1KMT2ARXFP1NUDT1 | |
| SCHEMBL16570654 | 0.81 | RIPK1 (0.41) | NPC1RAB9AMAPTALOX15MEN1 |
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 |