Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR8 | Q9NR97 | 8/20 | 0.45 |
| ▸ | TLR7 | Q9NYK1 | 8/20 | 0.45 |
| ▸ | TLR9 | Q9NR96 | 6/20 | 0.45 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.39 |
| ▸ | BCR | P11274 | 1/20 | 0.39 |
| ▸ | NEK1 | Q96PY6 | 1/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.37 |
| ▸ | PIM1 | P11309 | 1/20 | 0.37 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.37 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1982709 | 0.90 | TLR8 (0.48) | TLR8TLR7TLR9ABL1BCR | |
| SCHEMBL1980014 | 0.88 | TLR7 (0.49) | TLR8TLR7TLR9ABL1BCR | |
| SCHEMBL1979037 | 0.85 | NEK1 (0.48) | TLR8TLR7MCHR1ABL1BCR | |
| SCHEMBL1980514 | 0.83 | PIM1 (0.44) | TLR8TLR7TLR9PIM1PIM3 | |
| SCHEMBL11907966 | 0.83 | CHEK1 (0.38) | TLR8TLR7TLR9PIM1PIM3 | |
| SCHEMBL12597359 | 0.83 | SLC2A1 (0.45) | TLR8TLR7ABL1BCRNEK1 | |
| SCHEMBL1981277 | 0.82 | WNT1 (0.49) | TLR8TLR7TLR9MCHR1ABL1 | |
| SCHEMBL12597621 | 0.82 | TLR9 (0.41) | TLR8TLR7TLR9NEK1ROCK2 | |
| SCHEMBL1978130 | 0.81 | TLR7 (0.48) | TLR8TLR7TLR9MCHR1ABL1 | |
| SCHEMBL12597820 | 0.81 | TLR9 (0.40) | TLR8TLR7TLR9MCHR1ABL1 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |
| 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 |