Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 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 | |
|---|---|---|---|---|
| SCHEMBL3125324 | 0.71 | TSHR (0.43) | L3MBTL1TSHRACHEALDH1A1CYP3A4 | |
| SCHEMBL9321200 | 0.71 | TSHR (0.39) | L3MBTL1TSHRACHEALDH1A1LMNA | |
| SCHEMBL11241586 | 0.71 | ATM (0.41) | TSHRALDH1A1NPSR1CYP3A4 | |
| SCHEMBL16933983 | 0.68 | KIF11 (0.37) | TSHRACHEALDH1A1GABRA1GABRB2 | |
| SCHEMBL11245391 | 0.68 | TSHR (0.39) | TSHRACHEALDH1A1MAPTTDP1 | |
| SCHEMBL27708717 | 0.68 | TSHR (0.40) | L3MBTL1TSHRACHEALDH1A1MEN1 | |
| SCHEMBL11839304 | 0.67 | CASP1 (0.43) | L3MBTL1TSHRACHE | |
| SCHEMBL11253680 | 0.67 | KIF11 (0.41) | ACHEALDH1A1LMNAMAPTCYP3A4 | |
| SCHEMBL31521770 | 0.67 | TSHR (0.50) | TSHRACHEALDH1A1LMNAMAPT | |
| SCHEMBL12925871 | 0.67 | TSHR (0.50) | TSHRACHEALDH1A1LMNAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-4366170-A | 1,2-Dibromo-2-cyano-2-(aryl)ethane(propane) antimicrobial compounds | MERCK & CO., INC. (US) | 1982-12-28 | — | — | US | claimed |
| US-4366170-A | 1,2-Dibromo-2-cyano-2-(aryl)ethane(propane) antimicrobial compounds | MERCK & CO., INC. (US) | 1982-12-28 | — | — | US | disclosed |