Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.32 |
| ▸ | ADH1B | P00325 | 1/20 | 0.31 |
| ▸ | ADH1C | P00326 | 1/20 | 0.31 |
| ▸ | ADH1A | P07327 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1745 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL28817307 | 0.88 | — | — | |
| Ammonia Solution, Strong SCHEMBL28186859 | 0.88 | — | — | |
| Methylene Chloride SCHEMBL27882248 | 0.86 | TSHR (0.46) | TSHRALDH1A1TDP1L3MBTL1SMN1; SMN2 | |
| Acetone SCHEMBL27460064 | 0.86 | TSHR (0.52) | TSHRALDH1A1TDP1L3MBTL1SMN1; SMN2 | |
| SCHEMBL16447031 | 0.86 | TSHR (0.46) | TSHRALDH1A1TDP1L3MBTL1SMN1; SMN2 | |
| SCHEMBL7809363 | 0.84 | TSHR (0.42) | TSHRALDH1A1TDP1L3MBTL1SMN1; SMN2 | |
| Butane SCHEMBL5396024 | 0.84 | TSHR (0.45) | TSHRALDH1A1TDP1L3MBTL1SMN1; SMN2 | |
| Acetic Acid SCHEMBL28133213 | 0.84 | TSHR (0.50) | TSHRALDH1A1TDP1L3MBTL1SMN1; SMN2 | |
| SCHEMBL1417559 | 0.82 | TSHR (0.43) | TSHRALDH1A1TDP1L3MBTL1SMN1; SMN2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105814038-B | Benzimidazole derivatives as EP4 ligands | 拜耳医药股份公司 | 2018-12-04 | — | — | CN | disclosed |
| CN-104854098-B | Benzimidazole derivatives as EP4 antagonists | 拜耳医药股份公司 | 2018-01-09 | — | — | CN | disclosed |
| CN-105814038-A | Benzimidazole derivatives as EP4 ligands | 拜耳医药股份公司 | 2016-07-27 | — | — | CN | disclosed |
| CN-104854098-A | NOVEL BENZIMIDAZOLE DERIVATIVES AS EP4 ANTAGONISTS | Bayer Pharma AG | 2015-08-19 | — | — | CN | disclosed |