Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 1/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | TACR1 | P25103 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4637988 | 0.91 | PTGDR2 (0.40) | CCR1PTGDR2AKR1C3TP53GRM5 | |
| SCHEMBL4638053 | 0.87 | ALDH1A1 (0.44) | PTGDR2AKR1C3AKR1C2MAPTHTT | |
| SCHEMBL4637813 | 0.84 | IDH1 (0.39) | PTGDR2AKR1C3AKR1C2SMN1; SMN2HTT | |
| SCHEMBL4637949 | 0.84 | IDH1 (0.39) | PTGDR2AKR1C3TP53AKR1C2MAPT | |
| SCHEMBL4707915 | 0.82 | IDH1 (0.48) | PTGDR2HTTL3MBTL1GAAALDH1A1 | |
| SCHEMBL4637887 | 0.82 | USP2 (0.36) | PTGDR2AKR1C3AKR1C2MEN1KMT2A | |
| SCHEMBL4638552 | 0.81 | TACR1 (0.40) | CCR1PTGDR2AKR1C3AKR1C2MAPT | |
| SCHEMBL4637824 | 0.76 | ALDH1A1 (0.44) | PTGDR2AKR1C3AKR1C2SMN1; SMN2GAA | |
| SCHEMBL4637753 | 0.76 | IDH1 (0.47) | PTGDR2AKR1C3TP53AKR1C2MAPT | |
| SCHEMBL4637729 | 0.76 | PTGDR2 (0.41) | PTGDR2SMN1; SMN2HTTGAATACR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1501808-B1 | TACHYKININ RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-07-02 | — | — | EP | disclosed |
| EP-1501809-B1 | TRIAZOLE DERIVATIVES AS TACHYKININ RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-01-16 | — | — | EP | disclosed |