Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 5/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.36 |
| ▸ | CCR1 | P32246 | 1/20 | 0.35 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.35 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.35 |
| ▸ | RORB | Q92753 | 2/20 | 0.35 |
| ▸ | RORC | P51449 | 1/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4637984 | 0.90 | TACR1 (0.39) | TACR1KDM4EHTTSMN1; SMN2MAPT | |
| SCHEMBL4638051 | 0.87 | ALDH1A1 (0.39) | TACR1KDM4EHTTSMN1; SMN2MAPT | |
| SCHEMBL4637811 | 0.84 | GRM2 (0.36) | TACR1KDM4EHTTSMN1; SMN2MAPT | |
| SCHEMBL4637948 | 0.84 | RORB (0.36) | TACR1KDM4EHTTSMN1; SMN2MAPT | |
| SCHEMBL4638481 | 0.82 | IDH1 (0.44) | TACR1SMN1; SMN2MAPTGAAP2RX7 | |
| SCHEMBL4637883 | 0.82 | P2RX7 (0.35) | TACR1KDM4EHTTSMN1; SMN2MAPT | |
| SCHEMBL4638554 | 0.81 | CCR1 (0.39) | TACR1KDM4EHTTSMN1; SMN2MAPT | |
| SCHEMBL4637820 | 0.76 | GAA (0.40) | TACR1KDM4EHTTSMN1; SMN2GAA | |
| SCHEMBL4637750 | 0.76 | IDH1 (0.43) | HTTSMN1; SMN2MAPTAKR1C3AKR1C2 | |
| SCHEMBL4759328 | 0.76 | RORB (0.43) | TACR1KDM4EHTTSMN1; SMN2GAA |
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 |