Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.32 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.32 |
| ▸ | ACE | P12821 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 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 | |
|---|---|---|---|---|
| SCHEMBL7139127 | 0.87 | CYP2D6 (0.37) | CYP2D6CYP2C19POLBCYP2C9KMT2A | |
| SCHEMBL7140993 | 0.84 | CYP2D6 (0.42) | HSD17B10CYP2D6CYP2C19POLBCYP2C9 | |
| SCHEMBL273928 | 0.82 | HSD17B10 (0.42) | HSD17B10CYP2D6CYP2C19POLBCYP2C9 | |
| SCHEMBL16416532 | 0.76 | P2RX7 (0.36) | BLMITGB3ITGA2B | |
| SCHEMBL3489028 | 0.74 | S1PR1 (0.41) | HSD17B10POLBTSHRALDH1A1 | |
| SCHEMBL23291436 | 0.73 | CYP2D6 (0.63) | CYP2D6CYP2C19POLBCYP2C9KMT2A | |
| SCHEMBL2544936 | 0.72 | PIK3CD (0.55) | HSD17B10POLBKMT2ATSHRSLC6A9 | |
| Lithium Ion SCHEMBL23291466 | 0.71 | CYP2D6 (0.60) | CYP2D6CYP2C19POLBCYP2C9KMT2A | |
| Hydrochloric Acid SCHEMBL2543735 | 0.70 | PIK3CD (0.53) | HSD17B10TSHRSLC6A9 | |
| SCHEMBL30875935 | 0.70 | ITGB3 (0.43) | CYP2D6CYP2C19POLBCYP2C9KMT2A |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-6172325-A | — | — | None | — | — | JP | disclosed |
| EP-0740015-B1 | Ethylenediaminetriacetic acid and salts thereof as chelating agents in pulp bleaching | HAMPSHIRE CHEMICAL CORP (US) | 2000-01-26 | — | — | EP | disclosed |
| EP-0740015-A1 | Ethylenediaminetriacetic acid and salts thereof as chelating agents in pulp bleaching | HAMPSHIRE CHEMICAL CORPORATION (US) | 1996-10-30 | — | — | EP | disclosed |
| US-5449822-A | Preparation of ethylenediaminetriacetic acid | HAMPSHIRE CHEMICAL CORP. (US) | 1995-09-12 | — | — | US | disclosed |
| JP-H06172325-A | 1-CYANOMETHYL-4-CARBOXYMETHYL-2-KETOPIPERAZINE, ITS SALT AND PREPARATION THEREOF | WR GRACE & CO CONNECTICUT | 1994-06-21 | — | — | JP | disclosed |
| US-5250728-A | Reacting formaldehyde with salt of ethylenediaminediacetic acid, reacting with cyanide source, cyclizing, reacting with base | HAMPSHIRE CHEMICAL CORP. (US) | 1993-10-05 | — | — | US | disclosed |
| US-5250728-A | Reacting formaldehyde with salt of ethylenediaminediacetic acid, reacting with cyanide source, cyclizing, reacting with base | HAMPSHIRE CHEMICAL CORP. (US) | 1993-10-05 | — | — | US | disclosed |