Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 7/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.33 |
| ▸ | PIK3R1 | P27986 | 3/20 | 0.33 |
| ▸ | AKT1 | P31749 | 3/20 | 0.33 |
| ▸ | AKT2 | P31751 | 3/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.33 |
| ▸ | AKT3 | Q9Y243 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4374035 | 0.84 | CYP17A1 (0.49) | CYP17A1CYP19A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL10770402 | 0.82 | CYP17A1 (0.44) | CYP17A1CYP19A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL28227574 | 0.81 | TBXAS1 (0.47) | CYP17A1CYP19A1CYP3A4CYP2D6TBXAS1 | |
| SCHEMBL28650976 | 0.81 | TBXAS1 (0.47) | CYP17A1CYP19A1CYP3A4CYP2D6TBXAS1 | |
| SCHEMBL2929068 | 0.80 | CYP17A1 (0.46) | CYP17A1CYP19A1TBXAS1 | |
| Hydrochloric Acid SCHEMBL28362531 | 0.77 | CYP17A1 (0.44) | CYP17A1CYP19A1TBXAS1 | |
| SCHEMBL72311 | 0.73 | — | — | |
| SCHEMBL29109568 | 0.72 | CYP26A1 (0.39) | CYP17A1CYP19A1PIK3R1AKT1AKT2 | |
| Hydrochloric Acid SCHEMBL9020718 | 0.71 | CYP17A1 (0.42) | CYP17A1CYP19A1CYP3A4 | |
| SCHEMBL29109605 | 0.69 | CYP26A1 (0.40) | CYP19A1PIK3R1AKT1AKT2PIK3CA |
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-0849338-B1 | Ink composition for ink-jet printer | SAMSUNG ELECTRONICS CO LTD (KR) | 2003-06-18 | — | — | EP | disclosed |
| US-5989327-A | WATER SOLUBLE INK COMPRISING A SOLVENT, A PIGMENT, AND A HYDROPHILIC OLIGOMERIC DISPERSANT; COLORFASTNESS, WASHFASTNESS, STORAGE STABILITY | SAMSUNG ELECTRONICS CO., LTD. (KR) | 1999-11-23 | — | — | US | disclosed |
| EP-0849338-A1 | Ink composition for ink-jet printer | Samsung Electronics Co., Ltd. (KR) | 1998-06-24 | — | — | EP | disclosed |