Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 1/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.32 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | BRS3 | P32247 | 1/20 | 0.31 |
| ▸ | DHODH | Q02127 | 1/20 | 0.30 |
| ▸ | EIF4A1 | P60842 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL6170666 | 0.71 | TSHR (0.53) | LMNAMAPTKDM4EALDH1A1L3MBTL1 | |
| SCHEMBL8357062 | 0.70 | ALDH1A1 (0.36) | LMNAMAPTKDM4EBRS3ALDH1A1 | |
| SCHEMBL12109510 | 0.64 | KDM4E (0.46) | LMNAMAPTKDM4EALDH1A1TDP1 | |
| SCHEMBL5970052 | 0.64 | TSHR (0.55) | LMNAKDM4EDHODHALDH1A1CYP3A4 | |
| SCHEMBL82573 | 0.63 | TSHR (0.60) | LMNAKDM4EALDH1A1CYP3A4TDP1 | |
| SCHEMBL8421782 | 0.63 | ALDH1A1 (0.38) | LMNAMAPTKDM4EALDH1A1CYP3A4 | |
| SCHEMBL6948237 | 0.62 | TSHR (0.50) | LMNAMAPTKDM4EALDH1A1TDP1 | |
| SCHEMBL9197306 | 0.62 | RIPK1 (0.48) | LMNAMAPTKDM4EALDH1A1L3MBTL1 | |
| SCHEMBL4713440 | 0.62 | TSHR (0.52) | LMNAKDM4EALDH1A1CYP3A4TDP1 | |
| SCHEMBL5734087 | 0.62 | TRIM24 (0.50) | MAPTTRIM24TRIM33ALDH1A1HPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6100252-A | SPECIFIED COMPOUNDS INCLUDING METHYL 2-BUTYL-1-((2'-(2-OXO-3H-1,2,3,5-OXATHIADIAZOL-4-YL)BIPHENYL) METHYL)-BENZIMIDAZOLE-7-CARBOXYLATE; USE TO TREAT CIRCULATORY DISEASES SUCH AS HYPERTENSIVE DISEASES AND HEART DISEASES | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2000-08-08 | — | — | US | disclosed |