Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.31 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.31 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.31 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.30 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8724187 | 0.82 | CYP3A4 (0.35) | CYP3A4TSHRHSD17B10CYP11B1CYP11B2 | |
| SCHEMBL8724347 | 0.77 | CYP3A4 (0.45) | CYP3A4TSHRHSD17B10CYP11B1CYP11B2 | |
| SCHEMBL8726035 | 0.76 | — | — | |
| SCHEMBL8726118 | 0.72 | CYP3A4 (0.45) | CYP3A4TSHRHSD17B10CYP11B1CYP11B2 | |
| SCHEMBL8720924 | 0.69 | CYP3A4 (0.38) | CYP3A4TSHRHSD17B10CYP11B1CYP11B2 | |
| SCHEMBL8724069 | 0.67 | CYP11B1 (0.33) | CYP3A4TSHRHSD17B10CYP11B1CYP11B2 | |
| SCHEMBL29163972 | 0.66 | — | — | |
| SCHEMBL8721430 | 0.65 | CYP3A4 (0.34) | CYP3A4TSHRHSD17B10CYP11B1CYP11B2 | |
| SCHEMBL8720945 | 0.65 | CYP3A4 (0.38) | CYP3A4TSHRCYP11B1CYP11B2LMNA | |
| SCHEMBL8721411 | 0.64 | TSHR (0.51) | CYP3A4NPC1TSHRHSD17B10CYP11B1 |
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-1998000430-A1 | IMIDAZOL DERIVATIVES USEFUL AS NITROGEN MONOXIDE SYNTHASE INHIBITORS | SCHERING AKTIENGESELLSCHAFT (DE) | 1998-01-08 | — | — | WO | disclosed |