Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.41 |
| ▸ | CPT2 | P23786 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | ACACB | O00763 | 1/20 | 0.35 |
| ▸ | ACACA | Q13085 | 1/20 | 0.35 |
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.34 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL15183508 | 0.78 | CA2 (0.39) | TDP1FFAR1CPT2CA2MAPK1 | |
| SCHEMBL23879883 | 0.78 | GSR (0.52) | SLC1A2SLC1A1SLC1A3GRIK1GRIK2 | |
| SCHEMBL29060165 | 0.78 | HSPD1 (0.36) | TDP1FFAR1CPT2CA2MAPK1 | |
| SCHEMBL15183510 | 0.74 | ACACB (0.45) | TDP1FFAR1CPT2CA2MAPK1 | |
| SCHEMBL15062352 | 0.74 | TDP1 (0.48) | TDP1FFAR1CPT2GPR84PPARD | |
| SCHEMBL4838885 | 0.74 | BHMT (0.49) | SLC1A2SLC1A1SLC1A3GRIK1GRIK2 | |
| SCHEMBL4837844 | 0.74 | BHMT (0.49) | SLC1A2SLC1A1SLC1A3GRIK1GRIK2 | |
| SCHEMBL1786605 | 0.74 | GPR84 (0.36) | TDP1FFAR1CPT2ACACBACACA | |
| SCHEMBL13106387 | 0.74 | FFAR1 (0.59) | TDP1FFAR1CPT2CHRM1ADRA1A | |
| SCHEMBL1298190 | 0.73 | MEN1 (0.41) | TDP1FFAR1CPT2 |
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-9890198-B2 | Cyclosporin derivatives and uses thereof | S&T GLOBAL INC. (US) | 2018-02-13 | — | — | US | disclosed |