Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 4/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | HRH1 | P35367 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | METAP1 | P53582 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4633347 | 1.00 | GPR84 (0.45) | GPR84HDAC1HDAC2CHRM1AKR1A1 | |
| SCHEMBL10599123 | 1.00 | GPR84 (0.45) | GPR84HDAC1HDAC2CHRM1AKR1A1 | |
| SCHEMBL4744405 | 0.87 | GPR84 (0.52) | GPR84ALDH1A1FFAR4FFAR1 | |
| SCHEMBL667414 | 0.87 | GPR84 (0.52) | GPR84ALDH1A1FFAR4FFAR1 | |
| SCHEMBL17113879 | 0.85 | GPR84 (0.60) | GPR84MAPTFFAR4FFAR1 | |
| SCHEMBL4957082 | 0.84 | GPR84 (0.63) | GPR84TDP1SLC22A6ALDH1A1MAPT | |
| SCHEMBL1483983 | 0.84 | GPR84 (0.63) | GPR84TDP1SLC22A6ALDH1A1MAPT | |
| SCHEMBL17867252 | 0.82 | SLC22A6 (0.40) | GPR84ADRA1ATDP1SLC22A6SMN1; SMN2 | |
| SCHEMBL2988034 | 0.82 | GPR84 (0.45) | GPR84HDAC1HDAC2CHRM1AKR1A1 | |
| SCHEMBL16600585 | 0.81 | GPR84 (0.48) | GPR84HDAC1HDAC2CHRM1AKR1A1 |
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-4864056-A | METHYL 3-HYDROXY-2,4-DIMETHYLHEPTANOATE | NITTO ELECTRIC INDUSTRIAL CO., LTD. (JP) | 1989-09-05 | — | — | US | claimed |
| US-4864056-A | METHYL 3-HYDROXY-2,4-DIMETHYLHEPTANOATE | NITTO ELECTRIC INDUSTRIAL CO., LTD. (JP) | 1989-09-05 | — | — | US | disclosed |