Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 4/20 | 0.55 |
| ▸ | DRD3 | P35462 | 4/20 | 0.55 |
| ▸ | DRD1 | P21728 | 3/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | HTR1A | P08908 | 4/20 | 0.52 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.52 |
| ▸ | DRD5 | P21918 | 2/20 | 0.52 |
| ▸ | HTR2A | P28223 | 2/20 | 0.52 |
| ▸ | HTR7 | P34969 | 2/20 | 0.52 |
| ▸ | HRH1 | P35367 | 2/20 | 0.52 |
| ▸ | DRD4 | P21917 | 1/20 | 0.52 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL30416085 | 1.00 | DRD2 (0.55) | DRD2DRD3DRD1POLBKCNH2 | |
| SCHEMBL30417093 | 0.84 | DRD2 (0.60) | DRD2DRD3DRD1POLBKCNH2 | |
| SCHEMBL16546679 | 0.84 | ALDH1A1 (0.55) | POLBKCNH2HTR1APLD1KDM4E | |
| SCHEMBL5676073 | 0.81 | ALDH1A1 (0.52) | POLBKCNH2HTR1AKDM4EALDH1A1 | |
| SCHEMBL6551956 | 0.81 | ALDH1A1 (0.52) | POLBKCNH2HTR1AKDM4EALDH1A1 | |
| SCHEMBL13711971 | 0.81 | KCNH2 (0.71) | DRD2DRD3DRD1POLBKCNH2 | |
| SCHEMBL21353591 | 0.80 | — | — | |
| SCHEMBL29857922 | 0.80 | PLD1 (0.73) | POLBKCNH2PLD1KDM4EALDH1A1 | |
| SCHEMBL15800694 | 0.80 | PLD1 (0.73) | POLBKCNH2PLD1KDM4EALDH1A1 | |
| SCHEMBL23252409 | 0.78 | POLB (0.59) | DRD2POLBKCNH2HTR1ADRD4 |
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-9914712-B2 | Antibacterial thiazolecarboxylic acids | ANTABIO SAS (FR) | 2018-03-13 | — | — | US | disclosed |