Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.55 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.55 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.55 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.55 |
| ▸ | HTR2A | P28223 | 1/20 | 0.55 |
| ▸ | HTR2C | P28335 | 1/20 | 0.55 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.55 |
| ▸ | HRH1 | P35367 | 1/20 | 0.55 |
| ▸ | DRD3 | P35462 | 1/20 | 0.55 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.55 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | PAM | P19021 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL17961063 | 0.92 | DGKA (0.55) | CA2MAPK1KMT2ATSHRPAM | |
| SCHEMBL30732583 | 0.90 | DGKA (0.53) | TDP1CA2MAPK1KMT2ACYP3A4 | |
| SCHEMBL6458253 | 0.88 | CA2 (0.55) | TDP1CHRM1AKR1A1CHRM3HTR2A | |
| SCHEMBL29242738 | 0.86 | GRIK1 (0.49) | TDP1CHRM1AKR1A1CHRM3HTR2A | |
| SCHEMBL28712162 | 0.86 | KMT2A (0.50) | TDP1CYP1A2KMT2ACYP3A4TSHR | |
| SCHEMBL14360165 | 0.86 | CA2 (0.53) | TDP1CYP1A2CA2MAPK1KMT2A | |
| SCHEMBL18000928 | 0.86 | PAM (0.49) | KMT2APAMDGKAGRIK1GRIK2 | |
| Ethyl Tetradecanoate SCHEMBL8000997 | 0.86 | MAPT (0.54) | KMT2APAMDGKAGRIK1GRIK2 | |
| SCHEMBL28005123 | 0.86 | KMT2A (0.49) | TDP1CHRM1AKR1A1CHRM3HTR2A | |
| SCHEMBL31231845 | 0.85 | CA2 (0.58) | TDP1CA2MAPK1KMT2ACYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105348185-B | Bicyclic [3.2.1] octyl group amide derivatives and application thereof | H.隆德贝克有限公司 | 2018-02-16 | — | — | CN | disclosed |
| CN-105348185-A | Bicyclo[3.2.1]octyl amide derivatives and uses of same | LUNDBECK & CO AS H | 2016-02-24 | — | — | CN | disclosed |
| CN-103369961-B | Bicyclo [3.2.1] octylamide derivatives and uses thereof | H. LUNDBECK A/S (DK) | 2015-11-25 | — | — | CN | disclosed |