Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 6/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.39 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.34 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.34 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | BMPR1B | O00238 | 3/20 | 0.31 |
| ▸ | BMPR1A | P36894 | 3/20 | 0.31 |
| ▸ | ACVRL1 | P37023 | 3/20 | 0.31 |
| ▸ | ACVR1 | Q04771 | 3/20 | 0.31 |
| ▸ | TGFBR1 | P36897 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16362060 | 0.83 | PTGER3 (0.40) | GPR55CYP11B2CYP11B1PDE3BPDE3A | |
| SCHEMBL16362104 | 0.80 | PTGER3 (0.40) | GPR55CYP11B2CYP11B1PDE3BPDE3A | |
| SCHEMBL17697814 | 0.72 | IL2 (0.46) | MAP3K5 | |
| SCHEMBL16362064 | 0.71 | IL2 (0.48) | GPR55CYP11B2CYP11B1MAP3K5 | |
| SCHEMBL16362422 | 0.70 | PTGER3 (0.39) | GPR55CYP11B2CYP11B1MAP3K5 | |
| SCHEMBL16362447 | 0.69 | IL2 (0.46) | MAP3K5 | |
| SCHEMBL16362059 | 0.68 | PTGER3 (0.39) | GPR55CYP11B2CYP11B1PDE3BPDE3A | |
| SCHEMBL16362103 | 0.68 | IL2 (0.48) | GPR55CYP11B2CYP11B1MAP3K5 | |
| SCHEMBL16362057 | 0.66 | IL2 (0.56) | GPR55GABRA5GABRG2GABRB3MAP3K5 | |
| SCHEMBL1119404 | 0.63 | CYP11B2 (0.68) | GPR55CYP11B2CYP11B1PDE3BPDE3A |
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 |
|---|---|---|---|---|---|---|---|
| US-9725463-B2 | Substituted heterocyclic compounds as CRAC modulators | LUPIN LIMITED (IN) | 2017-08-08 | — | — | US | disclosed |