Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 11/20 | 0.46 |
| ▸ | RXRA | P19793 | 1/20 | 0.44 |
| ▸ | RXRB | P28702 | 1/20 | 0.44 |
| ▸ | RXRG | P48443 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | DHODH | Q02127 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.40 |
| ▸ | PTPRC | P08575 | 1/20 | 0.40 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | PTPN2 | P17706 | 2/20 | 0.40 |
| ▸ | PTPN6 | P29350 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7496743 | 0.83 | IDO1 (0.52) | TACR1RXRARXRBRXRGIDO1 | |
| SCHEMBL7198646 | 0.82 | IDO1 (0.52) | TACR1IDO1CES2 | |
| SCHEMBL1015795 | 0.77 | LMNA (0.54) | TACR1RXRARXRBRXRGLMNA | |
| SCHEMBL504122 | 0.76 | RXRA (0.68) | TACR1RXRARXRBRXRGIDO1 | |
| SCHEMBL5663864 | 0.75 | TACR1 (0.42) | TACR1RXRARXRBRXRGIDO1 | |
| SCHEMBL13886119 | 0.74 | FFAR4 (0.44) | — | |
| SCHEMBL7812479 | 0.74 | LMNA (0.51) | TACR1RXRARXRBRXRGLMNA | |
| SCHEMBL2113930 | 0.72 | PPARD (0.52) | RXRARXRBRXRGLMNAPTPN1 | |
| SCHEMBL7907557 | 0.71 | CA2 (0.54) | TACR1IDO1 | |
| SCHEMBL29172383 | 0.71 | MAPT (0.53) | TACR1RXRARXRBRXRGLMNA |
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-1377565-A1 | TETRAHYDROPYRAN DERIVATIVES AS NEUROKININ RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME LTD. (GB) | 2004-01-07 | — | — | EP | disclosed |
| WO-2002057250-A1 | TETRAHYDROPYRAN DERIVATIVES AS NEUROKININ RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME LIMITED (GB) | 2002-07-25 | — | — | WO | disclosed |