Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.43 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | CASR | P41180 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 3/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.33 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2459987 | 0.81 | TSHR (0.43) | GABRA1GABRB2CA2TSHRACHE | |
| SCHEMBL20989634 | 0.79 | TSHR (0.41) | GABRA1GABRB2CA2TSHRACHE | |
| SCHEMBL6435840 | 0.77 | PDK1 (0.41) | GABRA1GABRB2ALDH1A1TDP1CYP2C9 | |
| SCHEMBL9128816 | 0.74 | GABRA1 (0.36) | GABRA1GABRB2TSHRACHEALDH1A1 | |
| SCHEMBL11883453 | 0.74 | L3MBTL1 (0.40) | GABRA1GABRB2TSHRACHEALDH1A1 | |
| Isopropyl Alcohol SCHEMBL27557142 | 0.74 | GABRA1 (0.37) | GABRA1GABRB2TSHRACHEALDH1A1 | |
| SCHEMBL796229 | 0.73 | GABRA1 (0.48) | GABRA1GABRB2CA2TSHRACHE | |
| SCHEMBL2495517 | 0.73 | TSHR (0.45) | GABRA1GABRB2CA2TSHRACHE | |
| SCHEMBL874172 | 0.73 | CASR (0.53) | GABRA1GABRB2CA2TSHRACHE | |
| SCHEMBL15976427 | 0.73 | GABRA1 (0.48) | GABRA1GABRB2CA2TSHRACHE |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20080281014-A1 | Nanosubstance-Containing Composition, Process for Producing the Same, and Composite Made With the Same | MITSUBISHI RAYON CO., LTD. (JP) | 2008-11-13 | — | — | US | disclosed |
| EP-0421366-B1 | Radiolabeled anticoagulant peptides | MERRELL DOW PHARMA (US) | 1995-07-19 | — | — | EP | disclosed |
| US-5279812-A | Polypeptide; amino acid sequence of hirudin | MERRELL DOW PHARMACEUTICALS INC. (US) | 1994-01-18 | — | — | US | disclosed |
| EP-0421366-A1 | Radiolabeled anticoagulant peptides | MERRELL DOW PHARMACEUTICALS INC. (US) | 1991-04-10 | — | — | EP | disclosed |