Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of [1,4']Bipiperidinyl. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL3 | Q96JM7 | 7/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 6/20 | 0.51 |
| ▸ | MBTD1 | Q05BQ5 | 4/20 | 0.44 |
| ▸ | HTR6 | P50406 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CHKA | P35790 | 1/20 | 0.42 |
| ▸ | TP53BP1 | Q12888 | 1/20 | 0.42 |
| ▸ | L3MBTL4 | Q8NA19 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | GABRP | O00591 | 1/20 | 0.41 |
| ▸ | GABRD | O14764 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.41 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.41 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.41 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.41 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| [1,4']Bipiperidinyl SCHEMBL27743042 | 0.92 | L3MBTL3 (0.49) | L3MBTL3L3MBTL1MBTD1HTR6HRH3 | |
| [1,4']Bipiperidinyl SCHEMBL5969295 | 0.90 | L3MBTL3 (0.48) | L3MBTL3L3MBTL1MBTD1HTR6HRH3 | |
| SCHEMBL3159634 | 0.89 | HTR6 (0.52) | L3MBTL3L3MBTL1MBTD1HTR6HRH3 | |
| [1,4']Bipiperidinyl SCHEMBL42685 | 0.89 | HTR6 (0.52) | L3MBTL3L3MBTL1MBTD1HTR6HRH3 | |
| [1,4']Bipiperidinyl SCHEMBL352141 | 0.89 | HTR6 (0.52) | L3MBTL3L3MBTL1MBTD1HTR6HRH3 | |
| [1,4']Bipiperidinyl SCHEMBL29018730 | 0.88 | L3MBTL3 (0.49) | L3MBTL3L3MBTL1MBTD1HTR6HRH3 | |
| [1,4']Bipiperidinyl SCHEMBL27870096 | 0.87 | L3MBTL3 (0.46) | L3MBTL3L3MBTL1MBTD1HTR6HRH3 | |
| Hydrochloric Acid SCHEMBL3571227 | 0.87 | HTR6 (0.50) | L3MBTL3L3MBTL1MBTD1HTR6HRH3 | |
| Hydrochloric Acid SCHEMBL5322658 | 0.87 | HTR6 (0.50) | L3MBTL3L3MBTL1MBTD1HTR6HRH3 | |
| [1,4']Bipiperidinyl SCHEMBL19410113 | 0.87 | HTR6 (0.50) | L3MBTL3L3MBTL1MBTD1HTR6HRH3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109796462-A | A kind of preparation method of irinotecan hydrochloride | 辰欣药业股份有限公司 | 2019-05-24 | — | — | CN | disclosed |