Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | HTR7 | P34969 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.45 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9013331 | 0.88 | HTR6 (0.60) | HTR6MAPTATM | |
| SCHEMBL11580156 | 0.77 | HTR6 (0.55) | HTR6ALDH1A1HTR7KDM4ESMN1; SMN2 | |
| SCHEMBL9013611 | 0.76 | MAPT (0.54) | ALDH1A1MAPTLMNAHTTATM | |
| Hydrochloric Acid SCHEMBL9013362 | 0.75 | MAPT (0.52) | ALDH1A1MAPTLMNAHTTATM | |
| SCHEMBL6600143 | 0.74 | HTR7 (0.54) | HTR7 | |
| Hydrochloric Acid SCHEMBL9013251 | 0.74 | ESR1 (0.61) | HTR6MAPTATMSMN1; SMN2 | |
| SCHEMBL11581555 | 0.70 | HTR6 (0.52) | HTR6ALDH1A1MAPTTDP1HTR7 | |
| SCHEMBL29904797 | 0.70 | HTR7 (1.00) | ALDH1A1HTR7KDM4ESMN1; SMN2ADRB2 | |
| SCHEMBL7273983 | 0.69 | MEN1 (0.55) | MAPTATM | |
| SCHEMBL10813059 | 0.69 | HTR7 (0.55) | ALDH1A1MAPTLMNAHTTTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0781766-B1 | HETEROCYCLIC DERIVATIVE AND MEDICINE | NIPPON SHINYAKU CO LTD (JP) | 2004-03-31 | — | — | EP | disclosed |
| US-6191149-B1 | DRUG FOR CEREBROVASCULAR DISEASE | NIPPON SHINYAKU, CO., LTD. (JP) | 2001-02-20 | — | — | US | disclosed |
| EP-0781766-A1 | HETEROCYCLIC DERIVATIVE AND MEDICINE | NIPPON SHINYAKU COMPANY, LIMITED (JP) | 1997-07-02 | — | — | EP | disclosed |