Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.38 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.37 |
| ▸ | EPAS1 | Q99814 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.34 |
| ▸ | SLC16A1 | P53985 | 1/20 | 0.34 |
| ▸ | MCTS1 | Q9ULC4 | 1/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.34 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | NLRP3 | Q96P20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4637701 | 0.95 | GPBAR1 (0.38) | TACR1ALDH1A1TSHRCYP19A1GPBAR1 | |
| SCHEMBL4637940 | 0.93 | IDH1 (0.41) | TACR1ALDH1A1TSHRGPBAR1EPAS1 | |
| SCHEMBL4637747 | 0.91 | EPAS1 (0.38) | TACR1ALDH1A1TSHRGPBAR1EPAS1 | |
| SCHEMBL4637809 | 0.89 | EPAS1 (0.36) | TACR1ALDH1A1TSHRGPBAR1EPAS1 | |
| SCHEMBL4639007 | 0.89 | GPBAR1 (0.37) | TACR1ALDH1A1TSHRCYP19A1GPBAR1 | |
| SCHEMBL4706457 | 0.88 | ALDH1A1 (0.44) | TACR1ALDH1A1TSHRCYP19A1GPBAR1 | |
| SCHEMBL4637945 | 0.84 | EPAS1 (0.37) | TACR1ALDH1A1TSHRGPBAR1EPAS1 | |
| SCHEMBL4638603 | 0.84 | ALDH1A1 (0.44) | TACR1ALDH1A1TSHRCYP19A1GPBAR1 | |
| SCHEMBL4637966 | 0.83 | KMT2A (0.41) | TACR1ALDH1A1GAAMAPTHPGD | |
| SCHEMBL4639402 | 0.83 | ALDH1A1 (0.40) | TACR1ALDH1A1TSHRCYP19A1GAA |
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 |