Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | DRD1 | P21728 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 5/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 5/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.33 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.33 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL27934675 | 0.91 | ALDH1A1 (0.38) | L3MBTL1ALDH1A1CHRNB4CHRNA3MEN1 | |
| SCHEMBL27608978 | 0.80 | TSHR (0.36) | L3MBTL1ALDH1A1TSHRMEN1KMT2A | |
| SCHEMBL27590541 | 0.80 | NISCH (0.32) | DRD3MAPT | |
| SCHEMBL27590506 | 0.78 | NPC1 (0.32) | TSHRSIRT1LMNASMN1; SMN2HTT | |
| SCHEMBL27590556 | 0.77 | NISCH (0.36) | DRD3ALDH1A1FFAR4MAPT | |
| SCHEMBL27608930 | 0.74 | NPC1 (0.32) | SIRT1LMNASMN1; SMN2 | |
| SCHEMBL27590551 | 0.74 | GRIA1 (0.31) | HTR1A | |
| SCHEMBL27590539 | 0.73 | GSK3B (0.33) | HTR1AALDH1A1HTT | |
| SCHEMBL27609187 | 0.73 | CREBBP (0.34) | — | |
| SCHEMBL27608922 | 0.69 | NPC1 (0.33) | TSHRSIRT1LMNASMN1; SMN2HTT |
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 |
|---|---|---|---|---|---|---|---|
| CN-101535276-B | 2, 4-diaminopyrimidine fused bicyclic derivatives as ALK and c-MET inhibitors | CEPHALON INC | 2013-08-28 | — | — | CN | disclosed |