Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | GRM5 | P41594 | 1/20 | 0.39 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.37 |
| ▸ | KIF11 | P52732 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1908316 | 0.85 | ALDH1A1 (0.65) | ALDH1A1TSHRCYP1A2KMT2AHTT | |
| SCHEMBL3613086 | 0.85 | ALDH1A1 (0.65) | ALDH1A1TSHRCYP1A2KMT2AHTT | |
| SCHEMBL27630546 | 0.81 | KCNN4 (0.51) | ALDH1A1TSHRCYP1A2KMT2AHTT | |
| SCHEMBL8905131 | 0.80 | MEN1 (0.47) | ALDH1A1CYP1A2KMT2AMEN1GRM5 | |
| Hydrochloric Acid SCHEMBL8500969 | 0.79 | KMT2A (0.46) | ALDH1A1CYP1A2KMT2AMEN1GRM5 | |
| SCHEMBL6701585 | 0.79 | CYP2C19 (0.41) | ALDH1A1TSHRCYP1A2KMT2AHTT | |
| SCHEMBL6367583 | 0.79 | CYP2C19 (0.41) | ALDH1A1TSHRCYP1A2KMT2AHTT | |
| SCHEMBL8905147 | 0.79 | KMT2A (0.40) | ALDH1A1CYP1A2KMT2AMEN1SMN1; SMN2 | |
| SCHEMBL1712531 | 0.78 | CYP1A2 (0.47) | ALDH1A1TSHRCYP1A2KMT2AHTT | |
| SCHEMBL1081535 | 0.78 | CYP1A2 (0.47) | ALDH1A1TSHRCYP1A2KMT2AHTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021133038-A1 | NOVEL AMIDE DERIVATIVE USEFUL AS DIACYLGLYCEROL ACYLTRANSFERASE 2 INHIBITOR, AND USE THEREOF | 주식회사 엘지화학 | 2021-07-01 | — | — | WO | disclosed |
| CN-109232464-A | Oxadiazoles type connexon and its application | 上海新理念生物医药科技有限公司 | 2019-01-18 | — | — | CN | disclosed |
| WO-2008139941-A1 | SUBSTITUTED IMIDAZOLE COMPOUND AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2008-11-20 | — | — | WO | disclosed |
| EP-1984355-A2 | CYCLIC AMINE COMPOUND AND USE THEREOF FOR THE PROPHYLAXIS OR TREATMENT OF HYPERTENSION | Takeda Pharmaceutical Company Limited (JP) | 2008-10-29 | — | — | EP | disclosed |
| WO-2007094513-A2 | CYCLIC AMINE COMPOUND AND USE THEREOF FOR THE PROPHYLAXIS OR TREATMENT OF HYPERTENSION | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-08-23 | — | — | WO | disclosed |
| CN-1185251-C | Novel LHRH-antagonists with improved solubility characteristics | ZANTARIS AG (DE) | 2005-01-19 | — | — | CN | disclosed |
| CN-1348462-A | Novel LHRH-antagonists with improved solubility characteristics | ZANTARIS AG (DE) | 2002-05-08 | — | — | CN | disclosed |