Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.41 |
| ▸ | KIF11 | P52732 | 2/20 | 0.40 |
| ▸ | CCR6 | P51684 | 2/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | LTA4H | P09960 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL289606 | 0.88 | GRIN2B (0.45) | GRIN2BMAPTEPHX2KIF11CCR6 | |
| SCHEMBL5239240 | 0.87 | LTA4H (0.47) | GRIN2BMAPTEPHX2KIF11SMN1; SMN2 | |
| SCHEMBL220074 | 0.84 | MAPT (0.47) | MAPTEPHX2KIF11KCNH2SMN1; SMN2 | |
| SCHEMBL30056405 | 0.82 | MAPT (0.45) | MAPTEPHX2KIF11KCNH2SMN1; SMN2 | |
| SCHEMBL7469958 | 0.82 | MAPT (0.45) | MAPTEPHX2KIF11KCNH2SMN1; SMN2 | |
| Bromide SCHEMBL28835121 | 0.80 | MAPT (0.44) | MAPTEPHX2KIF11SMN1; SMN2KMT2A | |
| Bromide SCHEMBL28835122 | 0.80 | MAPT (0.44) | MAPTEPHX2KIF11KCNH2SMN1; SMN2 | |
| SCHEMBL168125 | 0.79 | KIF11 (0.47) | GRIN2BMAPTEPHX2KIF11CCR6 | |
| SCHEMBL27862141 | 0.79 | KIF11 (0.47) | GRIN2BMAPTEPHX2KIF11CCR6 | |
| SCHEMBL4150750 | 0.78 | KIF11 (0.49) | MAPTEPHX2KIF11KCNH2ALDH1A1 |
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-1019410-A1 | SPIRO-PIPERIDINE DERIVATIVES AND THEIR USE AS TACHYKININ ANTAGONISTS | MERCK SHARP & DOHME LTD. (GB) | 2000-07-19 | — | — | EP | disclosed |
| WO-1997019084-A1 | SPIRO-PIPERIDINE DERIVATIVES AND THEIR USE AS TACHYKININ ANTAGONISTS | MERCK SHARP & DOHME LIMITED (GB) | 1997-05-29 | — | — | WO | disclosed |