Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 5/20 | 0.39 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.37 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 2/20 | 0.35 |
| ▸ | CFTR | P13569 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | KIT | P10721 | 1/20 | 0.34 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.34 |
| ▸ | BMPR1A | P36894 | 1/20 | 0.34 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.34 |
| ▸ | ACVRL1 | P37023 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 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 | |
|---|---|---|---|---|
| SCHEMBL24081071 | 0.80 | PHF13 (0.40) | NAMPTACVR1KITBMPR1BBMPR1A | |
| SCHEMBL24081049 | 0.74 | BMPR1B (0.53) | ACVR1BMPR1BBMPR1ATGFBR1ACVRL1 | |
| SCHEMBL24080970 | 0.70 | NOS3 (0.42) | PIK3C3CNR2 | |
| SCHEMBL24081037 | 0.68 | MAPK1 (0.45) | NAMPTNPC1CNR2 | |
| SCHEMBL17298875 | 0.66 | GABRA5 (0.44) | NAMPTCNR2CFTR | |
| SCHEMBL28798721 | 0.65 | PIK3C3 (0.46) | ACVR1PIK3C3NPC1BMPR1BBMPR1A | |
| SCHEMBL30908079 | 0.64 | NAMPT (0.51) | NAMPT | |
| SCHEMBL12302074 | 0.63 | KDM4E (0.60) | NAMPTCNR2 | |
| SCHEMBL15262659 | 0.62 | MAPK14 (0.44) | NAMPTNPC1CNR2CFTRAR | |
| SCHEMBL20788418 | 0.62 | L3MBTL1 (0.57) | NPC1 |
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-2020098720-A1 | FIVE-AND-SIX-MEMBERED HETEROCYCLIC COMPOUND AND USE THEREOF AS PROTEIN RECEPTOR KINASE INHIBITOR | 上海轶诺药业有限公司 | 2020-05-22 | — | — | WO | disclosed |