Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR2 | P50052 | 8/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | ACE | P12821 | 5/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL7161639 | 0.91 | PGR (0.35) | AGTR2ACE | |
| SCHEMBL7141654 | 0.85 | LTC4S (0.37) | MEN1LMNAKMT2A | |
| SCHEMBL7170300 | 0.84 | TAS2R14 (0.35) | — | |
| SCHEMBL7169997 | 0.84 | SMN1; SMN2 (0.37) | — | |
| SCHEMBL7170649 | 0.83 | LTC4S (0.37) | ACE | |
| SCHEMBL7163823 | 0.82 | PGR (0.40) | — | |
| SCHEMBL7165958 | 0.79 | AGTR2 (0.41) | AGTR2ACEMEN1USP2LMNA | |
| SCHEMBL7171997 | 0.77 | CXCR4 (0.40) | ACEMEN1USP2LMNAKMT2A | |
| SCHEMBL6327750 | 0.72 | TSHR (0.35) | — | |
| SCHEMBL6484834 | 0.72 | TACR1 (0.41) | AGTR2MEN1KMT2A |
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-2003082856-A1 | ISOQUINOLINE-3-CARBOXYLIC ACID DERIVATIVES AS EXCITATORY AMINO ACID RECEPTOR ANTAGONISTS | ELI LILLY AND COMPANY (US) | 2003-10-09 | — | — | WO | disclosed |