Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.35 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.35 |
| ▸ | SLC47A1 | Q96FL8 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11533529 | 0.83 | TAAR1 (0.36) | CYP3A4TSHRSLC22A2SLC22A1PGR | |
| SCHEMBL11533486 | 0.82 | ALDH1A1 (0.39) | CYP3A4TSHRSLC22A2SLC22A1PGR | |
| SCHEMBL11532046 | 0.82 | CYP2D6 (0.46) | CYP3A4TSHRSLC22A2SLC22A1PGR | |
| SCHEMBL11536457 | 0.82 | CASP1 (0.37) | CYP3A4TSHRSLC22A2SLC22A1PGR | |
| SCHEMBL11531659 | 0.78 | SLC22A2 (0.32) | CYP3A4TSHRSLC22A2SLC22A1PGR | |
| SCHEMBL11470956 | 0.78 | CASP1 (0.36) | CYP3A4TSHRSLC22A2SLC22A1PGR | |
| SCHEMBL11532210 | 0.78 | MAPK1 (0.38) | CYP3A4TSHRKCNH2TDP1CYP2D6 | |
| SCHEMBL11537087 | 0.77 | EBP (0.50) | CYP3A4TSHRSLC22A2SLC22A1PGR | |
| SCHEMBL11530730 | 0.77 | CYP2D6 (0.56) | CYP3A4TSHRSLC22A2SLC22A1PGR | |
| SCHEMBL11532266 | 0.75 | SIGMAR1 (0.43) | CYP3A4TSHRSLC22A2SLC22A1PGR |
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-4153797-A | α-Aryl-α, α-bis[ω- (disubstituted amino)alkyl]acetamides and related compounds | G. D. SEARLE & CO. (US) | 1979-05-08 | — | — | US | disclosed |
| US-4107205-A | α-Aryl-α,α-bis[ω-(disubstituted amino)alkyl]acetamides and related compounds | G. D. SEARLE & CO. (US) | 1978-08-15 | — | — | US | disclosed |