Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.43 |
| ▸ | IGF1R | P08069 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | DAO | P14920 | 3/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.36 |
| ▸ | CHKA | P35790 | 1/20 | 0.36 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19335922 | 0.91 | IGF1R (0.50) | TAAR1CYP1A2CYP2A6GRM2IGF1R | |
| SCHEMBL23552185 | 0.87 | GRM2 (0.41) | TAAR1CYP1A2CYP2A6GRM2BACE1 | |
| SCHEMBL18503373 | 0.87 | BACE1 (0.50) | TAAR1CYP1A2CYP2A6IGF1RALOX15 | |
| SCHEMBL18503378 | 0.87 | BACE1 (0.46) | TAAR1CYP1A2CYP2A6BACE1KCNH2 | |
| SCHEMBL19820863 | 0.85 | BACE1 (0.45) | TAAR1CYP1A2CYP2A6BACE1PTGS1 | |
| SCHEMBL19820866 | 0.85 | RARB (0.46) | TAAR1CYP1A2CYP2A6GRM2BACE1 | |
| SCHEMBL19820864 | 0.84 | PDE3B (0.45) | TAAR1CYP1A2CYP2A6BACE1PTGS1 | |
| SCHEMBL18890829 | 0.83 | TAAR1 (0.45) | TAAR1CYP1A2CYP2A6IGF1RALOX15 | |
| SCHEMBL23052989 | 0.81 | RARB (0.41) | TAAR1CYP1A2CYP2A6BACE1PTGS1 | |
| SCHEMBL9664122 | 0.81 | RARB (0.47) | TAAR1CYP1A2CYP2A6IGF1RALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3487955-B1 | LIQUID CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2020-05-20 | — | — | EP | disclosed |
| WO-2020064591-A1 | AZO DYE | MERCK PATENT GMBH (DE) | 2020-04-02 | — | — | WO | disclosed |
| EP-3475389-B1 | LIQUID CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2020-02-26 | — | — | EP | disclosed |
| WO-2019243216-A1 | LIQUID CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2019-12-26 | — | — | WO | disclosed |
| WO-2019238567-A1 | LIQUID CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2019-12-19 | — | — | WO | disclosed |
| US-20180195002-A1 | LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2018-07-12 | — | — | US | disclosed |
| WO-2018015320-A1 | LIQUID CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2018-01-25 | — | — | WO | disclosed |