Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.72 |
| ▸ | MAPT | P10636 | 5/20 | 0.72 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.72 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.72 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.72 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.64 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.64 |
| ▸ | GAA | P10253 | 1/20 | 0.64 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.64 |
| ▸ | MEN1 | O00255 | 3/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL234287 | 0.84 | ALDH1A1 (1.00) | ALDH1A1MAPTCYP2D6CYP2C19CYP1A2 | |
| SCHEMBL6285179 | 0.83 | ALDH1A1 (0.83) | ALDH1A1MAPTCYP2D6CYP2C19CYP1A2 | |
| SCHEMBL18230340 | 0.81 | TGFBR1 (0.59) | ALDH1A1MAPTCYP2D6CYP2C19CYP1A2 | |
| SCHEMBL6282476 | 0.80 | CYP19A1 (0.55) | ALDH1A1MAPTCYP2D6CYP2C19CYP1A2 | |
| SCHEMBL11040676 | 0.79 | ALOX5 (0.50) | ALDH1A1MAPTCYP2D6CYP2C19CYP1A2 | |
| SCHEMBL9727980 | 0.79 | TGFBR1 (0.51) | ALDH1A1MAPTCYP2D6CYP2C19CYP1A2 | |
| SCHEMBL11466268 | 0.79 | ALOX5 (0.69) | ALDH1A1MAPTCYP2D6CYP2C19CYP1A2 | |
| SCHEMBL9833618 | 0.79 | SMN1; SMN2 (0.51) | ALDH1A1MAPTCYP2D6CYP2C19CYP1A2 | |
| Hydrochloric Acid SCHEMBL6545368 | 0.79 | CYP19A1 (0.54) | ALDH1A1MAPTCYP2D6CYP2C19CYP1A2 | |
| SCHEMBL31060282 | 0.79 | TGFBR1 (1.00) | ALDH1A1MAPTCYP2D6CYP2C19CYP1A2 |
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-11193281-A | — | — | None | — | — | JP | disclosed |
| EP-1027050-B1 | 1,3-THIAZOLES AS ADENOSINE A3 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF ALLERGY, ASTHMA AND DIABETES | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2004-01-14 | — | — | EP | disclosed |
| US-6620825-B1 | 1,3-Azole compound substituted by pyridyl; administering as antiasthmatic, antiinflammatory or antiallergen agents | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2003-09-16 | — | — | US | disclosed |
| US-6436966-B1 | Adenosine A3 receptor antagonists | TAKEDA CHEMICAL IND., LTD. (JP) | 2002-08-20 | — | — | US | disclosed |
| EP-1027050-A2 | ADENOSINE A3 RECEPTOR ANTAGONISTS | Takeda Chemical Industries, Ltd. (JP) | 2000-08-16 | — | — | EP | disclosed |
| JP-H11193281-A | ADENOSINE A3 RECEPTOR ANTAGONISTIC AGENT AND THIAZOLE COMPOUND | TAKEDA CHEM IND LTD | 1999-07-21 | — | — | JP | disclosed |
| WO-1999021555-A2 | ADENOSINE A3 RECEPTOR ANTAGONISTS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1999-05-06 | — | — | WO | disclosed |