Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.53 |
| ▸ | CES1 | P23141 | 2/20 | 0.53 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.53 |
| ▸ | DAO | P14920 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 6/20 | 0.49 |
| ▸ | NPC1 | O15118 | 5/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL15309731 | 0.81 | TSHR (0.51) | CES2CES1KEAP1DAORAB9A | |
| SCHEMBL1937375 | 0.78 | RAB9A (0.58) | CES2CES1KEAP1DAORAB9A | |
| SCHEMBL619898 | 0.78 | CES2 (0.64) | CES2CES1KEAP1DAORAB9A | |
| SCHEMBL28409580 | 0.77 | HPGD (0.53) | CES2CES1KEAP1DAORAB9A | |
| SCHEMBL15163429 | 0.77 | HPGD (0.56) | CES2CES1KEAP1DAORAB9A | |
| SCHEMBL23793030 | 0.76 | RAB9A (0.56) | CES2CES1KEAP1DAORAB9A | |
| SCHEMBL14490190 | 0.76 | CES2 (0.61) | CES2CES1KEAP1DAORAB9A | |
| SCHEMBL29077328 | 0.76 | CES2 (0.61) | CES2CES1KEAP1DAORAB9A | |
| SCHEMBL6197413 | 0.76 | RAB9A (0.56) | CES2CES1KEAP1DAORAB9A | |
| SCHEMBL26056789 | 0.75 | CES2 (0.66) | CES2CES1KEAP1DAORAB9A |
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-101175746-A | Process for producing 3-substituted thiophene | UBE INDUSTRIES (JP) | 2008-05-07 | — | — | CN | disclosed |