Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.40 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.40 |
| ▸ | PIM1 | P11309 | 7/20 | 0.39 |
| ▸ | PIM3 | Q86V86 | 3/20 | 0.39 |
| ▸ | PIM2 | Q9P1W9 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NEK1 | Q96PY6 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | BRD2 | P25440 | 1/20 | 0.36 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.35 |
| ▸ | CLK2 | P49760 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1980602 | 0.87 | ABL1 (0.45) | TLR8TLR7PIM1PIM3PIM2 | |
| SCHEMBL1560888 | 0.83 | PIM1 (0.39) | PIM1PIM3PIM2NPC1RAB9A | |
| SCHEMBL12597224 | 0.83 | PTAFR (0.44) | TLR8TLR7DYRK1AALDH1A1 | |
| SCHEMBL1980257 | 0.82 | PIM1 (0.52) | TLR8TLR7PIM1PIM3PIM2 | |
| SCHEMBL1979037 | 0.82 | NEK1 (0.48) | TLR8TLR7PIM1PIM3PIM2 | |
| SCHEMBL12597452 | 0.80 | PIM1 (0.49) | TLR8TLR7PIM1PIM3PIM2 | |
| SCHEMBL1978448 | 0.79 | PIM1 (0.45) | TLR8TLR7PIM1PIM3PIM2 | |
| SCHEMBL1983423 | 0.79 | ABL1 (0.47) | TLR8TLR7PIM1DYRK1ACLK2 | |
| SCHEMBL1979784 | 0.79 | PKM (0.47) | ALDH1A1KDM4E | |
| SCHEMBL12597231 | 0.79 | NEK1 (0.52) | TLR8TLR7PIM1PIM3PIM2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011070299-A1 | TRI-SUBSTITUTED 9H-BETA-CARBOLINE (OR 9H-PYRIDO[3,4-B]INDOLE) DERIVATIVES, PREPARATION OF SAME AND THERAPEUTIC USE THEREOF | SANOFI-AVENTIS (FR) | 2011-06-16 | — | — | WO | disclosed |