Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | F10 | P00742 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | PIM1 | P11309 | 2/20 | 0.32 |
| ▸ | PIM3 | Q86V86 | 2/20 | 0.32 |
| ▸ | PIM2 | Q9P1W9 | 2/20 | 0.32 |
| ▸ | CTPS1 | P17812 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.32 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.32 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2049998 | 0.94 | SMN1; SMN2 (0.34) | ALDH1A1F10SMN1; SMN2CYP3A4PIM1 | |
| SCHEMBL21960888 | 0.80 | BAZ2B (0.39) | ALDH1A1POLBMAPTHPGD | |
| SCHEMBL27877217 | 0.77 | OPRM1 (0.36) | OPRM1F10PIM1PIM3PIM2 | |
| SCHEMBL4442669 | 0.76 | L3MBTL1 (0.43) | ALDH1A1OPRM1F10PIM1PIM3 | |
| SCHEMBL6611836 | 0.72 | PLA2G10 (0.43) | ALDH1A1SMN1; SMN2CYP3A4PKML3MBTL1 | |
| SCHEMBL23880197 | 0.71 | OPRM1 (0.35) | ALDH1A1OPRM1SMN1; SMN2PIM1PIM3 | |
| SCHEMBL27877237 | 0.70 | F10 (0.37) | ALDH1A1F10PIM1PIM3PIM2 | |
| SCHEMBL2794959 | 0.68 | MAP3K14 (0.38) | F10CYP3A4PIM1PIM3PIM2 | |
| SCHEMBL3500899 | 0.68 | RXRA (0.36) | ALDH1A1POLBGAAL3MBTL1HCAR3 | |
| SCHEMBL21961446 | 0.68 | PTGS2 (0.41) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2516444-A2 | HETEROCYCLIC COMPOUNDS AS JANUS KINASE INHIBITORS | BIOCRYST PHARMACEUTICALS, INC. (US) | 2012-10-31 | — | — | EP | disclosed |
| CN-102762571-A | Heterocyclic compounds as janus kinase inhibitors | BIOCRYST PHARM INC | 2012-10-31 | — | — | CN | disclosed |
| WO-2011079230-A2 | HETEROCYCLIC COMPOUNDS AS JANUS KINASE INHIBITORS | BIOCRYST PHARMACEUTICALS, INC. (US) | 2011-06-30 | — | — | WO | disclosed |