Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 8/20 | 0.42 |
| ▸ | CES2 | O00748 | 7/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11483327 | 0.80 | CES2 (0.57) | CES1CES2L3MBTL1MAPTTDP1 | |
| SCHEMBL9818141 | 0.80 | CES1 (0.50) | CES1CES2L3MBTL1MAPTTDP1 | |
| SCHEMBL8158420 | 0.80 | CES1 (0.50) | CES1CES2L3MBTL1MAPTTDP1 | |
| SCHEMBL6236596 | 0.79 | TRPV1 (0.43) | CES1CES2MAPTTDP1LMNA | |
| SCHEMBL10768795 | 0.77 | CES1 (0.48) | CES1CES2L3MBTL1MAPTLMNA | |
| SCHEMBL28780206 | 0.76 | TSHR (0.44) | CES1CES2MAPTTDP1LMNA | |
| SCHEMBL27782676 | 0.74 | CES2 (0.52) | CES1CES2L3MBTL1MAPTTDP1 | |
| SCHEMBL2555176 | 0.74 | CES1 (0.52) | CES1CES2L3MBTL1MAPTTDP1 | |
| SCHEMBL114583 | 0.73 | CES1 (0.58) | CES1CES2L3MBTL1MAPTTDP1 | |
| SCHEMBL523842 | 0.73 | CES1 (0.58) | CES1CES2L3MBTL1MAPTTDP1 |
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-107253903-A | Prepare a kind of method that can combine S1P acceptor compounds and its intermediate | 北京海步医药科技股份有限公司 | 2017-10-17 | — | — | CN | disclosed |