Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 2/20 | 0.33 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 3/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.31 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | TACR1 | P25103 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | CFTR | P13569 | 1/20 | 0.30 |
| ▸ | PPARG | P37231 | 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 | |
|---|---|---|---|---|
| SCHEMBL4639390 | 0.89 | GLS (0.35) | ABL1GPBAR1CYP11B1CYP11B2HCRTR1 | |
| SCHEMBL4639447 | 0.85 | IDH1 (0.35) | GPBAR1LMNASMN1; SMN2TSHRNPSR1 | |
| SCHEMBL4637794 | 0.84 | ALDH1A1 (0.36) | HCRTR1HCRTR2LMNAMAPK1SMN1; SMN2 | |
| SCHEMBL4637865 | 0.84 | ALDH1A1 (0.33) | LMNAMAPK1SMN1; SMN2TSHRNPSR1 | |
| SCHEMBL6426240 | 0.81 | ABL1 (0.38) | ABL1GPBAR1CYP11B1CYP11B2SMN1; SMN2 | |
| SCHEMBL4638945 | 0.76 | IDH1 (0.35) | CFTR | |
| SCHEMBL4638641 | 0.75 | IDH1 (0.41) | TSHRCFTR | |
| SCHEMBL4637728 | 0.75 | IDH1 (0.37) | GPBAR1TSHRTACR1CFTR | |
| SCHEMBL4637757 | 0.74 | ALDH1A1 (0.33) | TSHR | |
| SCHEMBL4638099 | 0.74 | IDH1 (0.36) | CYP11B1CYP11B2TSHRMAPTCFTR |
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 |
|---|---|---|---|---|---|---|---|
| EP-1501808-B1 | TACHYKININ RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-07-02 | — | — | EP | disclosed |