Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.32 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | LMNA | P02545 | 3/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.32 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 3/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.31 |
| ▸ | HTT | P42858 | 2/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL15439869 | 1.00 | CES2 (0.37) | CES2CES1ALDH1A1TSHRGLA | |
| SCHEMBL15439828 | 0.90 | CES2 (0.40) | CES2CES1ALDH1A1TSHRGLA | |
| SCHEMBL15439826 | 0.90 | CES2 (0.40) | CES2CES1ALDH1A1TSHRGLA | |
| SCHEMBL15439330 | 0.87 | CES2 (0.38) | CES2CES1ALDH1A1TSHRGLA | |
| SCHEMBL15439329 | 0.87 | CES2 (0.38) | CES2CES1ALDH1A1TSHRGLA | |
| SCHEMBL16492406 | 0.84 | ALDH1A1 (0.31) | ALDH1A1TSHRGLAMAPK1 | |
| SCHEMBL14799678 | 0.84 | ALDH1A1 (0.31) | ALDH1A1TSHRGLAMAPK1 | |
| SCHEMBL15439514 | 0.81 | TP53 (0.43) | CES2CES1ALDH1A1TSHRGLA | |
| SCHEMBL15439512 | 0.81 | TP53 (0.43) | CES2CES1ALDH1A1TSHRGLA | |
| SCHEMBL15440013 | 0.81 | CES2 (0.40) | CES2CES1ALDH1A1TSHRGLA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9115231-B2 | Polymers functionalized with protected hydrazone compounds containing an acyl group | BRIDGESTONE CORPORATION (JP) | 2015-08-25 | — | — | US | disclosed |
| US-20140031488-A1 | Polymers Functionalized With Protected Hydrazone Compounds Containing An Acyl Group | BRIDGESTONE CORPORATION (JP) | 2014-01-30 | — | — | US | disclosed |