Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | CRHBP | P24387 | 1/20 | 0.35 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.35 |
| ▸ | NR3C1 | P04150 | 3/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | PTPN7 | P35236 | 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 | |
|---|---|---|---|---|
| SCHEMBL471668 | 0.74 | HPGD (0.51) | SMN1; SMN2HCRTR1HCRTR2CYP2D6OPRD1 | |
| Hydrochloric Acid SCHEMBL17389942 | 0.73 | RXFP1 (0.43) | MAPTRXFP1 | |
| SCHEMBL17389928 | 0.72 | FASN (0.49) | SMN1; SMN2TSHRTP53MAPTRXFP1 | |
| SCHEMBL16150924 | 0.71 | RXFP1 (0.44) | SMN1; SMN2TSHRTP53KDM4EMAPT | |
| SCHEMBL28494019 | 0.71 | POLB (0.39) | SMN1; SMN2TSHRKDM4EMAPTRXFP1 | |
| SCHEMBL13425012 | 0.70 | ALDH1A1 (0.47) | SMN1; SMN2TSHRTP53KDM4EHDAC1 | |
| SCHEMBL6068880 | 0.69 | CES2 (0.55) | HCRTR1HCRTR2CYP2D6OPRD1KCNH2 | |
| SCHEMBL9150307 | 0.69 | CYP19A1 (0.48) | SMN1; SMN2TSHRKDM4EMAPTALDH1A1 | |
| SCHEMBL16149873 | 0.69 | RXFP1 (0.40) | SMN1; SMN2TSHRTP53KDM4EMAPT | |
| SCHEMBL254969 | 0.69 | ALDH1A1 (0.56) | SMN1; SMN2OPRD1TSHRTP53HDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3587406-B1 | 2-HYDROXY-1-{4-[(4-PHENYLPHENYL)CARBONYL]PIPERAZIN-1-YL}ETHAN-1-ONE DERIVATIVES AND RELATED COMPOUNDS AS FATTY ACID SYNTHASE (FASN) INHIBITORS FOR THE TREATMENT OF CANCER | FORMA THERAPEUTICS INC (US) | 2021-01-27 | — | — | EP | disclosed |