Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYK2 | P29597 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ELANE | P08246 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | PLAU | P00749 | 1/20 | 0.40 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.38 |
| ▸ | WNT3A | P56704 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL6280875 | 0.98 | TYK2 (0.49) | TYK2L3MBTL1MAPK1NPC1RAB9A | |
| SCHEMBL7149098 | 0.83 | GAA (0.50) | TYK2ELANEKDM4EALDH1A1PLAU | |
| Bromide SCHEMBL6284630 | 0.82 | GAA (0.49) | TYK2ELANEKDM4EALDH1A1PLAU | |
| SCHEMBL7148504 | 0.81 | JAK2 (0.50) | TYK2MAPK1CYP3A4ELANEALDH1A1 | |
| SCHEMBL7149331 | 0.80 | TSHR (0.50) | MAPK1NPC1RAB9ACYP1A2CYP2D6 | |
| Bromide SCHEMBL6280880 | 0.79 | JAK2 (0.49) | TYK2MAPK1CYP3A4ELANEALDH1A1 | |
| Bromide SCHEMBL6284643 | 0.79 | TSHR (0.49) | MAPK1NPC1RAB9ACYP1A2CYP2D6 | |
| SCHEMBL7843732 | 0.78 | KMT2A (0.39) | NPC1RAB9AELANEKDM4EALDH1A1 | |
| SCHEMBL3115655 | 0.76 | MEN1 (0.52) | TYK2L3MBTL1NPC1RAB9ACYP1A2 | |
| SCHEMBL27557768 | 0.75 | NPC1 (0.51) | TYK2L3MBTL1MAPK1NPC1RAB9A |
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-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 |