Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | DYRK1A | Q13627 | 5/20 | 0.42 |
| ▸ | CLK2 | P49760 | 4/20 | 0.42 |
| ▸ | CLK3 | P49761 | 4/20 | 0.42 |
| ▸ | PIM1 | P11309 | 11/20 | 0.41 |
| ▸ | PIM3 | Q86V86 | 3/20 | 0.41 |
| ▸ | PIM2 | Q9P1W9 | 3/20 | 0.41 |
| ▸ | WNT1 | P04628 | 3/20 | 0.41 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1982251 | 0.84 | PIM1 (0.42) | DYRK1ACLK2CLK3PIM1PIM3 | |
| SCHEMBL2216642 | 0.83 | CYP3A4 (0.41) | CYP3A4CYP2D6CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL1984242 | 0.80 | EPHX2 (0.46) | CYP2D6PIM1TGFBR1CHEK1ACHE | |
| SCHEMBL1981359 | 0.74 | WNT1 (0.50) | DYRK1ACLK2CLK3PIM1WNT1 | |
| SCHEMBL1980913 | 0.71 | PIM1 (0.54) | DYRK1ACLK2CLK3PIM1PIM3 | |
| SCHEMBL1979037 | 0.70 | NEK1 (0.48) | CYP3A4CYP2D6CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL1978999 | 0.70 | PIM1 (0.54) | DYRK1ACLK2CLK3PIM1PIM3 | |
| SCHEMBL1560462 | 0.70 | PIM1 (0.41) | CYP3A4CYP2D6CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL1980602 | 0.70 | ABL1 (0.45) | DYRK1ACLK2PIM1PIM3PIM2 | |
| SCHEMBL12598112 | 0.69 | TLR7 (0.45) | DYRK1ACLK2CLK3PIM1 |
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 |