Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 6/20 | 0.56 |
| ▸ | HTR1D | P28221 | 4/20 | 0.56 |
| ▸ | HTR1B | P28222 | 4/20 | 0.56 |
| ▸ | AR | P10275 | 1/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | ESR1 | P03372 | 1/20 | 0.51 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.51 |
| ▸ | HTR2A | P28223 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | DRD2 | P14416 | 1/20 | 0.50 |
| ▸ | HTR2C | P28335 | 1/20 | 0.50 |
| ▸ | DRD3 | P35462 | 1/20 | 0.50 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.50 |
| ▸ | HTR3B | O95264 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | NCF1 | P14598 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL20274115 | 0.87 | HTR1A (0.60) | HTR1AHTR1DHTR1BARUSP2 | |
| SCHEMBL5234760 | 0.81 | USP2 (0.56) | HTR1AHTR1DHTR1BARUSP2 | |
| SCHEMBL19284728 | 0.80 | USP2 (0.55) | HTR1AHTR1DHTR1BARUSP2 | |
| SCHEMBL30735738 | 0.80 | USP2 (0.55) | HTR1AHTR1DHTR1BARUSP2 | |
| SCHEMBL8691022 | 0.79 | AR (0.63) | ARALDH1A1MAPTHSD17B10TSHR | |
| SCHEMBL9643856 | 0.79 | HTR1A (0.74) | HTR1AHTR1DHTR1BUSP2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL7203515 | 0.77 | KDM4E (0.75) | HTR1AHTR1DHTR1BUSP2ALDH1A1 | |
| SCHEMBL3301622 | 0.77 | MAPT (0.71) | ALDH1A1MAPTSMN1; SMN2HSD17B10TSHR | |
| SCHEMBL21855757 | 0.75 | ADAMTS5 (0.58) | ALDH1A1MAPTSMN1; SMN2HSD17B10TSHR | |
| SCHEMBL10586177 | 0.75 | TSHR (0.71) | ALDH1A1MAPTSMN1; SMN2TSHRHTR7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0773937-A1 | NOVEL ARYL PIPERAZINE-DERIVED PIPERAZIDE DERIVATIVES, METHODS FOR THEIR PREPARATION, THEIR USE AS DRUGS AND PHARMACEUTICAL COMPOSITIONS COMPRISING SAME | PIERRE FABRE MEDICAMENT (FR) | 1997-05-21 | — | — | EP | disclosed |
| WO-1996002525-A1 | NOVEL ARYL PIPERAZINE-DERIVED PIPERAZIDE DERIVATIVES, METHODS FOR THEIR PREPARATION, THEIR USE AS DRUGS AND PHARMACEUTICAL COMPOSITIONS COMPRISING SAME | PIERRE FABRE MEDICAMENT (FR) | 1996-02-01 | — | — | WO | disclosed |