Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.44 |
| ▸ | LOX | P28300 | 1/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.41 |
| ▸ | NOS3 | P29474 | 3/20 | 0.41 |
| ▸ | NOS1 | P29475 | 3/20 | 0.41 |
| ▸ | NOS2 | P35228 | 3/20 | 0.41 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.35 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.35 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.35 |
| ▸ | SYK | P43405 | 2/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | CCR1 | P32246 | 1/20 | 0.34 |
| ▸ | CCR5 | P51681 | 1/20 | 0.34 |
| ▸ | CCR8 | P51685 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | KDM5A | P29375 | 1/20 | 0.34 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL13900847 | 0.88 | NOS3 (0.52) | MAOADYRK1ALOXLOXL2NOS3 | |
| SCHEMBL18415092 | 0.88 | NOS3 (0.47) | MAOADYRK1ALOXLOXL2NOS3 | |
| SCHEMBL16303312 | 0.83 | HTR2C (0.39) | MAOADYRK1ALOXLOXL2NOS3 | |
| SCHEMBL19822050 | 0.83 | PGR (0.40) | MAOADYRK1ALOXLOXL2NOS3 | |
| SCHEMBL19822087 | 0.83 | LOX (0.40) | MAOADYRK1ALOXLOXL2NOS3 | |
| SCHEMBL30340594 | 0.81 | GRM5 (0.47) | MAOADYRK1ALOXLOXL2NOS3 | |
| SCHEMBL2118728 | 0.81 | NOS3 (0.64) | MAOADYRK1ALOXLOXL2NOS3 | |
| SCHEMBL29883563 | 0.81 | NOS3 (0.64) | MAOADYRK1ALOXLOXL2NOS3 | |
| SCHEMBL2610398 | 0.81 | GRM5 (0.47) | MAOADYRK1ALOXLOXL2NOS3 | |
| SCHEMBL827951 | 0.81 | SYK (0.48) | MAOADYRK1ALOXLOXL2NOS3 |
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-102458581-B | N- (hetero) aryl-pyrrolidine derivatives of pyrazol-4-yl-pyrrolo [2, 3-d ] pyrimidines and pyrrol-3-yl-pyrrolo [2, 3-d ] pyrimidines as JANUS kinase inhibitors | INCYTE HOLDINGS CORP. (US) | 2016-03-30 | — | — | CN | disclosed |