Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSPD1 | P10809 | 1/20 | 0.49 |
| ▸ | BLM | P54132 | 1/20 | 0.49 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.41 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MMP1 | P03956 | 2/20 | 0.40 |
| ▸ | MMP2 | P08253 | 2/20 | 0.40 |
| ▸ | MMP3 | P08254 | 2/20 | 0.40 |
| ▸ | MMP7 | P09237 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3813330 | 0.94 | CYP2D6 (0.47) | HSPD1BLMHSPE1CYP2D6TSHR | |
| SCHEMBL29269935 | 0.85 | CA2 (0.43) | HSPD1BLMHSPE1GPR84CA2 | |
| SCHEMBL28611950 | 0.85 | CA2 (0.43) | HSPD1BLMHSPE1GPR84CA2 | |
| SCHEMBL28595732 | 0.85 | CA2 (0.43) | HSPD1BLMHSPE1GPR84CA2 | |
| SCHEMBL28597977 | 0.85 | CA2 (0.43) | HSPD1BLMHSPE1GPR84CA2 | |
| SCHEMBL28610201 | 0.85 | CA2 (0.43) | HSPD1BLMHSPE1GPR84CA2 | |
| SCHEMBL26597223 | 0.85 | GPR84 (0.44) | HSPD1BLMHSPE1GPR84CA2 | |
| SCHEMBL3744441 | 0.84 | FFAR4 (0.46) | HSPD1BLMHSPE1TSHRGPR84 | |
| SCHEMBL28430904 | 0.83 | ACACB (0.43) | HSPD1BLMHSPE1GPR84CA2 | |
| SCHEMBL29269990 | 0.83 | ACACB (0.43) | HSPD1BLMHSPE1GPR84CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-20100298432-A1 | Cosmetic Compositions Containing Esters of 2-Butyloctanol | COGNIS IP MANAGEMENT GMBH (DE) | 2010-11-25 | — | — | US | disclosed |