Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | ELOVL6 | Q9H5J4 | 5/20 | 0.44 |
| ▸ | MMP13 | P45452 | 3/20 | 0.43 |
| ▸ | MMP8 | P22894 | 2/20 | 0.43 |
| ▸ | MMP1 | P03956 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.43 |
| ▸ | HTR2C | P28335 | 2/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.41 |
| ▸ | SPR | P35270 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2048495 | 0.82 | HTR2A (0.59) | HTR2AMAPTMMP13MMP8MMP1 | |
| SCHEMBL28073023 | 0.80 | CA12 (0.46) | MAPTELOVL6MMP13MMP8MMP1 | |
| SCHEMBL27095423 | 0.78 | HTR2A (0.45) | HTR2AMAPTELOVL6MMP13MMP8 | |
| Hydrochloric Acid SCHEMBL27999953 | 0.77 | CA12 (0.42) | ELOVL6MMP13MMP8MMP1ALDH1A1 | |
| Cyanide SCHEMBL27638463 | 0.76 | HTR2A (0.54) | HTR2AMAPTMMP13MMP8MMP1 | |
| SCHEMBL11645759 | 0.75 | ELOVL6 (0.40) | HTR2AMAPTELOVL6MMP13MMP8 | |
| SCHEMBL777971 | 0.74 | MAPT (0.56) | HTR2AMAPTMMP13MMP8MMP1 | |
| SCHEMBL7541817 | 0.74 | HTR2A (0.56) | HTR2AMAPTMMP13MMP8MMP1 | |
| SCHEMBL11641150 | 0.74 | GABRR1 (0.41) | HTR2AMAPTELOVL6MMP13MMP8 | |
| SCHEMBL16863988 | 0.73 | HTR2A (0.56) | HTR2AMAPTELOVL6KCNH2HTR2C |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5164514-A | Antispasmodics | ROUSSEL UCLAF (FR) | 1992-11-17 | — | — | US | disclosed |
| US-5081130-A | Antispasmodic agents | ROUSSEL UCLAF (FR) | 1992-01-14 | — | — | US | disclosed |
| US-4990531-A | Antispasmodic agents | ROUSSEL UCLAF (FR) | 1991-02-05 | — | — | US | disclosed |