Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.35 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.35 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.35 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.35 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.35 |
| ▸ | DGAT1 | O75907 | 7/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1617974 | 0.98 | CYP2C19 (0.37) | CYP2C19USP2ALDH1A1LMNACYP1A2 | |
| SCHEMBL10727800 | 0.98 | CYP2C19 (0.37) | CYP2C19USP2ALDH1A1LMNACYP1A2 | |
| SCHEMBL10727790 | 0.98 | CYP2C19 (0.37) | CYP2C19USP2ALDH1A1LMNACYP1A2 | |
| SCHEMBL6079946 | 0.93 | DGAT1 (0.36) | CYP2C19USP2ALDH1A1LMNACYP1A2 | |
| SCHEMBL2765891 | 0.85 | DGAT1 (0.37) | CYP2C19USP2ALDH1A1LMNACYP1A2 | |
| SCHEMBL15658952 | 0.83 | GRIN1 (0.41) | ALDH1A1LMNATSHRGRIN2DGRIN3B | |
| SCHEMBL4130871 | 0.83 | GRIN1 (0.41) | ALDH1A1LMNATSHRGRIN2DGRIN3B | |
| SCHEMBL10729071 | 0.81 | MME (0.37) | LMNATSHRGRIN2DGRIN3BGRIN1 | |
| SCHEMBL10729067 | 0.81 | MME (0.37) | LMNATSHRGRIN2DGRIN3BGRIN1 | |
| SCHEMBL2692225 | 0.81 | GRIN1 (0.42) | LMNATSHRGRIN2DGRIN3BGRIN1 |
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-4906654-A | Cyclohept[b]indoleakanoic acids, pharmaceutical compositions and use | MERCK FROSST CANADA, INC. (CA) | 1990-03-06 | — | — | US | disclosed |
| EP-0304156-A1 | Cyclohept b indolealkanoic acids | MERCK FROSST CANADA INC. (CA) | 1989-02-22 | — | — | EP | disclosed |
| US-4775680-A | PROSTAGLANDIN ANTAGONISTS | MERCK & CO., INC. (US) | 1988-10-04 | — | — | US | disclosed |